2-methyl-5-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-methyl-5-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Openeye Name: 2-methyl-5-nitro-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]pyridine-3-carboxamide CAS Name: 2-methyl-5-nitro-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 2-methyl-5-nitro-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-methyl-5-nitro-nicotinamide Formula: C16H16N6O4 MolecularWeight: 356.33604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O4/c1-10-13(6-12(8-18-10)22(25)26)16(24)20-11-2-3-14(19-7-11)21-5-4-17-15(23)9-21/h2-3,6-8H,4-5,9H2,1H3,(H,17,23)(H,20,24)