4-nitro-3-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-N-(phenylmethyl)aniline

Systemtic Name: 4-nitro-3-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-N-(phenylmethyl)aniline Openeye Name: N-benzyl-3-[4-[3-(benzylamino)-4-nitro-phenyl]piperazin-1-yl]-4-nitro-aniline CAS Name: 4-nitro-3-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]-1-piperazinyl]-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-3-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-4-nitroaniline Traditional Name: benzyl-[3-[4-[3-(benzylamino)-4-nitro-phenyl]piperazino]-4-nitro-phenyl]amine Formula: C30H30N6O4 MolecularWeight: 538.597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C4=C(C=CC(=C4)NCC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)C4=C(C=CC(=C4)NCC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H30N6O4/c37-35(38)28-14-12-26(20-27(28)32-22-24-9-5-2-6-10-24)33-15-17-34(18-16-33)30-19-25(11-13-29(30)36(39)40)31-21-23-7-3-1-4-8-23/h1-14,19-20,31-32H,15-18,21-22H2