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

Systemtic Name: N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-phenyl-benzamide Openeye Name: N-[2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-2-oxo-ethyl]-4-phenyl-benzamide CAS Name: N-[2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-oxoethyl]-4-phenylbenzamide IUPAC Name: N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxoethyl]-4-phenylbenzamide Traditional Name: N-[2-keto-2-[4-(6-nitro-3-pyridyl)piperazino]ethyl]-4-phenyl-benzamide Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N5O4/c30-23(28-14-12-27(13-15-28)21-10-11-22(25-16-21)29(32)33)17-26-24(31)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-11,16H,12-15,17H2,(H,26,31)