6-(4-methylpiperazin-1-yl)-4-(phenylcarbonyl)pyridine-3-carboxylic acid

Systemtic Name: 6-(4-methylpiperazin-1-yl)-4-(phenylcarbonyl)pyridine-3-carboxylic acid Openeye Name: 4-benzoyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid CAS Name: 4-benzoyl-6-(4-methyl-1-piperazinyl)-3-pyridinecarboxylic acid IUPAC Name: 4-benzoyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid Traditional Name: 4-benzoyl-6-(4-methylpiperazino)nicotinic acid Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C(=C2)C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C(=C2)C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19N3O3/c1-20-7-9-21(10-8-20)16-11-14(15(12-19-16)18(23)24)17(22)13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H,23,24)