[3-nitro-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]-piperazin-1-yl-methanone

Systemtic Name: [3-nitro-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]-piperazin-1-yl-methanone Openeye Name: [3-nitro-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]-piperazin-1-yl-methanone CAS Name: [3-nitro-4-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]phenyl]-(1-piperazinyl)methanone IUPAC Name: [3-nitro-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]-piperazin-1-ylmethanone Traditional Name: [4-(4-nicotinoylpiperazino)-3-nitro-phenyl]-piperazino-methanone Formula: C21H24N6O4 MolecularWeight: 424.45306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N6O4/c28-20(25-8-6-22-7-9-25)16-3-4-18(19(14-16)27(30)31)24-10-12-26(13-11-24)21(29)17-2-1-5-23-15-17/h1-5,14-15,22H,6-13H2