5-acetamido-2-[4-(4-ethanoylphenyl)piperazin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 5-acetamido-2-[4-(4-ethanoylphenyl)piperazin-1-yl]pyridine-3-carboxylic acid Openeye Name: 5-acetamido-2-[4-(4-acetylphenyl)piperazin-1-yl]pyridine-3-carboxylic acid CAS Name: 5-acetamido-2-[4-(4-acetylphenyl)-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 5-acetamido-2-[4-(4-acetylphenyl)piperazin-1-yl]pyridine-3-carboxylic acid Traditional Name: 5-acetamido-2-[4-(4-acetylphenyl)piperazino]nicotinic acid Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3C(=O)O)NC(=O)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3C(=O)O)NC(=O)C

InChI

InChI=1S/C20H22N4O4/c1-13(25)15-3-5-17(6-4-15)23-7-9-24(10-8-23)19-18(20(27)28)11-16(12-21-19)22-14(2)26/h3-6,11-12H,7-10H2,1-2H3,(H,22,26)(H,27,28)