(1S,6R)-6-[[2-(phenylcarbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[[2-(phenylcarbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[(2-benzoylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[(2-benzoylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(2-benzoylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[(2-benzoylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H19NO4/c23-19(14-8-2-1-3-9-14)17-12-6-7-13-18(17)22-20(24)15-10-4-5-11-16(15)21(25)26/h1-9,12-13,15-16H,10-11H2,(H,22,24)(H,25,26)/t15-,16+/m1/s1