3-[4-(3-methylphenyl)piperazin-1-yl]carbonylbenzoic acid

Systemtic Name: 3-[4-(3-methylphenyl)piperazin-1-yl]carbonylbenzoic acid Openeye Name: 3-[4-(m-tolyl)piperazine-1-carbonyl]benzoic acid CAS Name: 3-[[4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]benzoic acid IUPAC Name: 3-[4-(3-methylphenyl)piperazine-1-carbonyl]benzoic acid Traditional Name: 3-[4-(m-tolyl)piperazine-1-carbonyl]benzoic acid Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C19H20N2O3/c1-14-4-2-7-17(12-14)20-8-10-21(11-9-20)18(22)15-5-3-6-16(13-15)19(23)24/h2-7,12-13H,8-11H2,1H3,(H,23,24)