6-[(3-methylphenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(3-methylphenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-(m-tolylcarbamoyl)-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(3-methylanilino)-oxomethyl]-2,5-diphenyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(3-methylphenyl)carbamoyl]-2,5-diphenylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-(m-tolylcarbamoyl)-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2C(C=CC(C2C(=O)O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2C(C=CC(C2C(=O)O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO3/c1-18-9-8-14-21(17-18)28-26(29)24-22(19-10-4-2-5-11-19)15-16-23(25(24)27(30)31)20-12-6-3-7-13-20/h2-17,22-25H,1H3,(H,28,29)(H,30,31)