N1,N4-bis[4-[(2,4-dinitrophenyl)amino]phenyl]benzene-1,4-diamine

Systemtic Name: N1,N4-bis[4-[(2,4-dinitrophenyl)amino]phenyl]benzene-1,4-diamine Openeye Name: N1,N4-bis[4-(2,4-dinitroanilino)phenyl]benzene-1,4-diamine CAS Name: N1,N4-bis[4-(2,4-dinitroanilino)phenyl]benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis[4-(2,4-dinitroanilino)phenyl]benzene-1,4-diamine Traditional Name: [4-[4-[4-(2,4-dinitroanilino)anilino]anilino]phenyl]-(2,4-dinitrophenyl)amine Formula: C30H22N8O8 MolecularWeight: 622.54448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])NC4=CC=C(C=C4)NC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=CC=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])NC4=CC=C(C=C4)NC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C30H22N8O8/c39-35(40)25-13-15-27(29(17-25)37(43)44)33-23-9-5-21(6-10-23)31-19-1-2-20(4-3-19)32-22-7-11-24(12-8-22)34-28-16-14-26(36(41)42)18-30(28)38(45)46/h1-18,31-34H