[2-[[4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] (1S)-cyclohex-3-ene-1-carboxylate

Systemtic Name: [2-[[4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] (1S)-cyclohex-3-ene-1-carboxylate Openeye Name: [2-[4-(methylcarbamoyl)anilino]-2-oxo-ethyl] (1S)-cyclohex-3-ene-1-carboxylate CAS Name: (1S)-1-cyclohex-3-enecarboxylic acid [2-[4-(methylcarbamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(methylcarbamoyl)anilino]-2-oxoethyl] (1S)-cyclohex-3-ene-1-carboxylate Traditional Name: (1S)-cyclohex-3-ene-1-carboxylic acid [2-keto-2-[4-(methylcarbamoyl)anilino]ethyl] ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2CCC=CC2

Isomeric SMILES

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

InChI

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