ethyl (1S,6R)-4-[(4-aminocarbonylphenyl)amino]-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6R)-4-[(4-aminocarbonylphenyl)amino]-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-4-(4-carbamoylanilino)-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-4-(4-carbamoylanilino)-6-methyl-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-4-(4-carbamoylanilino)-6-methyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-4-(4-carbamoylanilino)-2-keto-6-methyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)NC2=CC=C(C=C2)C(=O)N)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC(=CC1=O)NC2=CC=C(C=C2)C(=O)N)C

InChI

InChI=1S/C17H20N2O4/c1-3-23-17(22)15-10(2)8-13(9-14(15)20)19-12-6-4-11(5-7-12)16(18)21/h4-7,9-10,15,19H,3,8H2,1-2H3,(H2,18,21)/t10-,15+/m1/s1