1-(4-nitrophenyl)-N-[4-[2-(4-nitrophenyl)-1,3-diazinan-1-yl]butyl]methanimine

Systemtic Name: 1-(4-nitrophenyl)-N-[4-[2-(4-nitrophenyl)-1,3-diazinan-1-yl]butyl]methanimine Openeye Name: 1-(4-nitrophenyl)-N-[4-[2-(4-nitrophenyl)hexahydropyrimidin-1-yl]butyl]methanimine CAS Name: 1-(4-nitrophenyl)-N-[4-[2-(4-nitrophenyl)-1,3-diazinan-1-yl]butyl]methanimine IUPAC Name: 1-(4-nitrophenyl)-N-[4-[2-(4-nitrophenyl)-1,3-diazinan-1-yl]butyl]methanimine Traditional Name: (4-nitrobenzylidene)-[4-[2-(4-nitrophenyl)hexahydropyrimidin-1-yl]butyl]amine Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(N(C1)CCCCN=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CNC(N(C1)CCCCN=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O4/c27-25(28)19-8-4-17(5-9-19)16-22-12-1-2-14-24-15-3-13-23-21(24)18-6-10-20(11-7-18)26(29)30/h4-11,16,21,23H,1-3,12-15H2