5-acetamido-2-(4-phenylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-acetamido-2-(4-phenylpiperazin-1-yl)benzoic acid Openeye Name: 5-acetamido-2-(4-phenylpiperazin-1-yl)benzoic acid CAS Name: 5-acetamido-2-(4-phenyl-1-piperazinyl)benzoic acid IUPAC Name: 5-acetamido-2-(4-phenylpiperazin-1-yl)benzoic acid Traditional Name: 5-acetamido-2-(4-phenylpiperazino)benzoic acid Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H21N3O3/c1-14(23)20-15-7-8-18(17(13-15)19(24)25)22-11-9-21(10-12-22)16-5-3-2-4-6-16/h2-8,13H,9-12H2,1H3,(H,20,23)(H,24,25)