5-(propanoylamino)-2-(4-pyridin-2-ylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-(propanoylamino)-2-(4-pyridin-2-ylpiperazin-1-yl)benzoic acid Openeye Name: 5-(propanoylamino)-2-[4-(2-pyridyl)piperazin-1-yl]benzoic acid CAS Name: 5-(1-oxopropylamino)-2-[4-(2-pyridinyl)-1-piperazinyl]benzoic acid IUPAC Name: 5-(propanoylamino)-2-(4-pyridin-2-ylpiperazin-1-yl)benzoic acid Traditional Name: 5-propionamido-2-[4-(2-pyridyl)piperazino]benzoic acid Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=N3)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C19H22N4O3/c1-2-18(24)21-14-6-7-16(15(13-14)19(25)26)22-9-11-23(12-10-22)17-5-3-4-8-20-17/h3-8,13H,2,9-12H2,1H3,(H,21,24)(H,25,26)