N1,N4-bis[(2-azanyl-5-nitro-phenyl)methyl]benzene-1,4-diamine

Systemtic Name: N1,N4-bis[(2-azanyl-5-nitro-phenyl)methyl]benzene-1,4-diamine Openeye Name: N1,N4-bis[(2-amino-5-nitro-phenyl)methyl]benzene-1,4-diamine CAS Name: N1,N4-bis[(2-amino-5-nitrophenyl)methyl]benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis[(2-amino-5-nitrophenyl)methyl]benzene-1,4-diamine Traditional Name: (2-amino-5-nitro-benzyl)-[4-[(2-amino-5-nitro-benzyl)amino]phenyl]amine Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=C(C=CC(=C2)[N+](=O)[O-])N)NCC3=C(C=CC(=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1NCC2=C(C=CC(=C2)[N+](=O)[O-])N)NCC3=C(C=CC(=C3)[N+](=O)[O-])N

InChI

InChI=1S/C20H20N6O4/c21-19-7-5-17(25(27)28)9-13(19)11-23-15-1-2-16(4-3-15)24-12-14-10-18(26(29)30)6-8-20(14)22/h1-10,23-24H,11-12,21-22H2