6-[(4-benzamido-3-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(4-benzamido-3-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(4-benzamido-3-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(4-benzamido-3-methylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(4-benzamido-3-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(4-benzamido-3-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CC=CCC2C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CC=CCC2C(=O)O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-14-13-16(23-21(26)17-9-5-6-10-18(17)22(27)28)11-12-19(14)24-20(25)15-7-3-2-4-8-15/h2-8,11-13,17-18H,9-10H2,1H3,(H,23,26)(H,24,25)(H,27,28)