2-nitro-5-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-N-(phenylmethyl)aniline

Systemtic Name: 2-nitro-5-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]piperazin-1-yl]-N-(phenylmethyl)aniline Openeye Name: N-benzyl-5-[4-[3-(benzylamino)-4-nitro-phenyl]piperazin-1-yl]-2-nitro-aniline CAS Name: 2-nitro-5-[4-[4-nitro-3-[(phenylmethyl)amino]phenyl]-1-piperazinyl]-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-5-[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-2-nitroaniline Traditional Name: benzyl-[5-[4-[3-(benzylamino)-4-nitro-phenyl]piperazino]-2-nitro-phenyl]amine Formula: C30H30N6O4 MolecularWeight: 538.597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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