2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[2-[(3-chloroanilino)-oxomethyl]anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C21H21ClN2O4/c22-13-6-5-7-14(12-13)23-20(26)17-10-3-4-11-18(17)24-19(25)15-8-1-2-9-16(15)21(27)28/h3-7,10-12,15-16H,1-2,8-9H2,(H,23,26)(H,24,25)(H,27,28)