MCP For Claude Marketplace
Organic Compound Nomenclature

Organic Compound Nomenclature MCP Connector for Claude

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Precise IUPAC naming and chemical property analysis for organic molecules.

4 tools Official Updated Oct 1, 2026 Official Vinkius Partner
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This MCP server provides a professional-grade engine for organic chemistry analysis. It allows AI agents to translate molecular structures or common names into precise IUPAC systematic names using the get_systematic_name tool. Users can identify compounds via identify_compound, retrieve fundamental chemical properties like molecular formulas and mass with get_molecular_details, and discover constitutional isomers using find_structural_isomers. It is designed to handle functional groups, stereochemistry, and complex substituents accurately.

iupacorganic-chemistrymolecular-structuresmilesnomenclature

4 tools expose this connector's capabilities to your AI agent.

find_structural_isomers

Identifies and lists the unique structural isomers for a given molecular formula

get_molecular_details

Provides the fundamental chemical properties of the molecule

get_systematic_name

Generates the precise IUPAC name for a given compound

identify_compound

Converts a provided molecular structure or a common name into a standardized internal representation

See how to talk to your AI agent using Organic Compound Nomenclature.

What is the IUPAC name for the SMILES string CCO?

The IUPAC name for the compound with SMILES CCO is ethanol.

Find the molecular formula for benzene.

The molecular formula for benzene is C6H6.

Identify the compound from the common name 'Acetone'.

The compound Acetone is identified as propan-2-one with the SMILES string CC(=O)C.

The server accepts SMILES strings, molecular structure representations, or well-known common names through the `identify_compound` tool.

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