2-[4-(3-methylphenyl)piperazin-1-yl]pyridine-4-carboxylic acid

Systemtic Name: 2-[4-(3-methylphenyl)piperazin-1-yl]pyridine-4-carboxylic acid Openeye Name: 2-[4-(m-tolyl)piperazin-1-yl]pyridine-4-carboxylic acid CAS Name: 2-[4-(3-methylphenyl)-1-piperazinyl]-4-pyridinecarboxylic acid IUPAC Name: 2-[4-(3-methylphenyl)piperazin-1-yl]pyridine-4-carboxylic acid Traditional Name: 2-[4-(m-tolyl)piperazino]isonicotinic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O2/c1-13-3-2-4-15(11-13)19-7-9-20(10-8-19)16-12-14(17(21)22)5-6-18-16/h2-6,11-12H,7-10H2,1H3,(H,21,22)