5-[4-(2-methylphenyl)carbonylpiperazin-1-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[4-(2-methylphenyl)carbonylpiperazin-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[4-(2-methylbenzoyl)piperazin-1-yl]benzoic acid CAS Name: 2-hydroxy-5-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]benzoic acid IUPAC Name: 2-hydroxy-5-[4-(2-methylbenzoyl)piperazin-1-yl]benzoic acid Traditional Name: 2-hydroxy-5-(4-o-toluoylpiperazino)benzoic acid Formula: C19H20N2O4 MolecularWeight: 340.3731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C19H20N2O4/c1-13-4-2-3-5-15(13)18(23)21-10-8-20(9-11-21)14-6-7-17(22)16(12-14)19(24)25/h2-7,12,22H,8-11H2,1H3,(H,24,25)