methyl 4-[2-cyano-3-(cyclohexylamino)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[2-cyano-3-(cyclohexylamino)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[2-cyano-3-(cyclohexylamino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[2-cyano-3-(cyclohexylamino)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2CCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2CCCCC2

InChI

InChI=1S/C18H20N2O3/c1-23-18(22)14-9-7-13(8-10-14)11-15(12-19)17(21)20-16-5-3-2-4-6-16/h7-11,16H,2-6H2,1H3,(H,20,21)