1-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(3-cyanoanilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-(3-cyanoanilino)-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(3-cyanoanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(3-cyanoanilino)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC=CC(=C2)C#N)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC=CC(=C2)C#N)C(=O)O

InChI

InChI=1S/C16H18N2O3/c17-11-12-5-4-6-13(9-12)18-14(19)10-16(15(20)21)7-2-1-3-8-16/h4-6,9H,1-3,7-8,10H2,(H,18,19)(H,20,21)