N-[(3-bromophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline

Systemtic Name: N-[(3-bromophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline Openeye Name: N-[(3-bromophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline CAS Name: N-[(3-bromophenyl)methyl]-2-nitro-5-(1-piperazinyl)aniline IUPAC Name: N-[(3-bromophenyl)methyl]-2-nitro-5-piperazin-1-ylaniline Traditional Name: (3-bromobenzyl)-(2-nitro-5-piperazino-phenyl)amine Formula: C17H19BrN4O2 MolecularWeight: 391.26236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H19BrN4O2/c18-14-3-1-2-13(10-14)12-20-16-11-15(4-5-17(16)22(23)24)21-8-6-19-7-9-21/h1-5,10-11,19-20H,6-9,12H2