1-[(3-cyanophenyl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(3-cyanophenyl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[(3-cyanobenzoyl)amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[(3-cyanophenyl)-oxomethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(3-cyanobenzoyl)amino]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[(3-cyanobenzoyl)amino]-4-methyl-cyclohexanecarboxylic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H18N2O3/c1-11-5-7-16(8-6-11,15(20)21)18-14(19)13-4-2-3-12(9-13)10-17/h2-4,9,11H,5-8H2,1H3,(H,18,19)(H,20,21)