3-[[(3-bromophenyl)amino]methyl]-N-[(3-nitrophenyl)methyl]aniline

Systemtic Name: 3-[[(3-bromophenyl)amino]methyl]-N-[(3-nitrophenyl)methyl]aniline Openeye Name: 3-[(3-bromoanilino)methyl]-N-[(3-nitrophenyl)methyl]aniline CAS Name: 3-[(3-bromoanilino)methyl]-N-[(3-nitrophenyl)methyl]aniline IUPAC Name: 3-[(3-bromoanilino)methyl]-N-[(3-nitrophenyl)methyl]aniline Traditional Name: [3-[(3-bromoanilino)methyl]phenyl]-(3-nitrobenzyl)amine Formula: C20H18BrN3O2 MolecularWeight: 412.27982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=CC(=CC=C2)[N+](=O)[O-])CNC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=CC(=CC=C2)[N+](=O)[O-])CNC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrN3O2/c21-17-6-3-8-19(12-17)23-13-15-4-1-7-18(10-15)22-14-16-5-2-9-20(11-16)24(25)26/h1-12,22-23H,13-14H2