2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]-N-phenyl-benzamide

Systemtic Name: 2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]-N-phenyl-benzamide Openeye Name: 2-[3-[4-(6-nitro-3-pyridyl)piperazin-1-yl]propanoylamino]-N-phenyl-benzamide CAS Name: 2-[[3-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-1-oxopropyl]amino]-N-phenylbenzamide IUPAC Name: 2-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanoylamino]-N-phenylbenzamide Traditional Name: 2-[3-[4-(6-nitro-3-pyridyl)piperazino]propanoylamino]-N-phenyl-benzamide Formula: C25H26N6O4 MolecularWeight: 474.51174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N6O4/c32-24(28-22-9-5-4-8-21(22)25(33)27-19-6-2-1-3-7-19)12-13-29-14-16-30(17-15-29)20-10-11-23(26-18-20)31(34)35/h1-11,18H,12-17H2,(H,27,33)(H,28,32)