5-benzamido-2-[4-(4-ethanoylphenyl)piperazin-1-yl]benzoic acid

Systemtic Name: 5-benzamido-2-[4-(4-ethanoylphenyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-5-benzamido-benzoic acid CAS Name: 2-[4-(4-acetylphenyl)-1-piperazinyl]-5-benzamidobenzoic acid IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-5-benzamidobenzoic acid Traditional Name: 2-[4-(4-acetylphenyl)piperazino]-5-benzamido-benzoic acid Formula: C26H25N3O4 MolecularWeight: 443.4944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H25N3O4/c1-18(30)19-7-10-22(11-8-19)28-13-15-29(16-14-28)24-12-9-21(17-23(24)26(32)33)27-25(31)20-5-3-2-4-6-20/h2-12,17H,13-16H2,1H3,(H,27,31)(H,32,33)