[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (1S)-cyclohex-3-ene-1-carboxylate

Systemtic Name: [2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (1S)-cyclohex-3-ene-1-carboxylate Openeye Name: [2-(3-acetamidoanilino)-2-oxo-ethyl] (1S)-cyclohex-3-ene-1-carboxylate CAS Name: (1S)-1-cyclohex-3-enecarboxylic acid [2-(3-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetamidoanilino)-2-oxoethyl] (1S)-cyclohex-3-ene-1-carboxylate Traditional Name: (1S)-cyclohex-3-ene-1-carboxylic acid [2-(3-acetamidoanilino)-2-keto-ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)C2CCC=CC2

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)[C@H]2CCC=CC2

InChI

InChI=1S/C17H20N2O4/c1-12(20)18-14-8-5-9-15(10-14)19-16(21)11-23-17(22)13-6-3-2-4-7-13/h2-3,5,8-10,13H,4,6-7,11H2,1H3,(H,18,20)(H,19,21)/t13-/m1/s1