N-[3-[4-(3-benzamido-2,2-dinitro-propyl)piperazin-1-yl]-2,2-dinitro-propyl]benzamide

Systemtic Name: N-[3-[4-(3-benzamido-2,2-dinitro-propyl)piperazin-1-yl]-2,2-dinitro-propyl]benzamide Openeye Name: N-[3-[4-(3-benzamido-2,2-dinitro-propyl)piperazin-1-yl]-2,2-dinitro-propyl]benzamide CAS Name: N-[3-[4-(3-benzamido-2,2-dinitropropyl)-1-piperazinyl]-2,2-dinitropropyl]benzamide IUPAC Name: N-[3-[4-(3-benzamido-2,2-dinitropropyl)piperazin-1-yl]-2,2-dinitropropyl]benzamide Traditional Name: N-[3-[4-(3-benzamido-2,2-dinitro-propyl)piperazino]-2,2-dinitro-propyl]benzamide Formula: C24H28N8O10 MolecularWeight: 588.52672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CNC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-])CC(CNC(=O)C3=CC=CC=C3)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(CNC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-])CC(CNC(=O)C3=CC=CC=C3)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H28N8O10/c33-21(19-7-3-1-4-8-19)25-15-23(29(35)36,30(37)38)17-27-11-13-28(14-12-27)18-24(31(39)40,32(41)42)16-26-22(34)20-9-5-2-6-10-20/h1-10H,11-18H2,(H,25,33)(H,26,34)