(1R,6S)-6-[(3-acetamidophenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[(3-acetamidophenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[(3-acetamidophenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[(3-acetamidoanilino)-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(3-acetamidophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[(3-acetamidophenyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H21N2O4- MolecularWeight: 329.37034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=CC(=CC=C2)NC(=O)C)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NC2=CC(=CC=C2)NC(=O)C)C(=O)[O-])C

InChI

InChI=1S/C18H22N2O4/c1-10-7-15(16(18(23)24)8-11(10)2)17(22)20-14-6-4-5-13(9-14)19-12(3)21/h4-6,9,15-16H,7-8H2,1-3H3,(H,19,21)(H,20,22)(H,23,24)/p-1/t15-,16+/m0/s1