1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 6-keto-1-[2-keto-2-(4-methylpiperazino)ethyl]nicotinic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)CN2C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C13H17N3O4/c1-14-4-6-15(7-5-14)12(18)9-16-8-10(13(19)20)2-3-11(16)17/h2-3,8H,4-7,9H2,1H3,(H,19,20)