3-[2-[4-(3-chlorophenyl)carbonylpiperidin-1-yl]ethanoylamino]benzoic acid

Systemtic Name: 3-[2-[4-(3-chlorophenyl)carbonylpiperidin-1-yl]ethanoylamino]benzoic acid Openeye Name: 3-[[2-[4-(3-chlorobenzoyl)-1-piperidyl]acetyl]amino]benzoic acid CAS Name: 3-[[2-[4-[(3-chlorophenyl)-oxomethyl]-1-piperidinyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-[4-(3-chlorobenzoyl)piperidin-1-yl]acetyl]amino]benzoic acid Traditional Name: 3-[[2-[4-(3-chlorobenzoyl)piperidino]acetyl]amino]benzoic acid Formula: C21H21ClN2O4 MolecularWeight: 400.85544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC(=CC=C2)Cl)CC(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC(=CC=C2)Cl)CC(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H21ClN2O4/c22-17-5-1-3-15(11-17)20(26)14-7-9-24(10-8-14)13-19(25)23-18-6-2-4-16(12-18)21(27)28/h1-6,11-12,14H,7-10,13H2,(H,23,25)(H,27,28)