3-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-4-phenylazanyl-benzamide

Systemtic Name: 3-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-4-phenylazanyl-benzamide Openeye Name: 4-anilino-3-nitro-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 4-anilino-3-nitro-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 4-anilino-3-nitro-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: 4-anilino-N-[6-(3-ketopiperazino)-3-pyridyl]-3-nitro-benzamide Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4/c29-21-14-27(11-10-23-21)20-9-7-17(13-24-20)26-22(30)15-6-8-18(19(12-15)28(31)32)25-16-4-2-1-3-5-16/h1-9,12-13,25H,10-11,14H2,(H,23,29)(H,26,30)