N1,N1,N4,N4-tetrakis[(4-nitrophenyl)methyl]benzene-1,4-diamine

Systemtic Name: N1,N1,N4,N4-tetrakis[(4-nitrophenyl)methyl]benzene-1,4-diamine Openeye Name: N1,N1,N4,N4-tetrakis[(4-nitrophenyl)methyl]benzene-1,4-diamine CAS Name: N1,N1,N4,N4-tetrakis[(4-nitrophenyl)methyl]benzene-1,4-diamine IUPAC Name: 1-N,1-N,4-N,4-N-tetrakis[(4-nitrophenyl)methyl]benzene-1,4-diamine Traditional Name: [4-[bis(4-nitrobenzyl)amino]phenyl]-bis(4-nitrobenzyl)amine Formula: C34H28N6O8 MolecularWeight: 648.62152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(CC4=CC=C(C=C4)[N+](=O)[O-])CC5=CC=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(CC4=CC=C(C=C4)[N+](=O)[O-])CC5=CC=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C34H28N6O8/c41-37(42)31-9-1-25(2-10-31)21-35(22-26-3-11-32(12-4-26)38(43)44)29-17-19-30(20-18-29)36(23-27-5-13-33(14-6-27)39(45)46)24-28-7-15-34(16-8-28)40(47)48/h1-20H,21-24H2