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

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-2-nitro-5-piperazin-1-yl-aniline Openeye Name: N-[1-(3-bromophenyl)ethyl]-2-nitro-5-piperazin-1-yl-aniline CAS Name: N-[1-(3-bromophenyl)ethyl]-2-nitro-5-(1-piperazinyl)aniline IUPAC Name: N-[1-(3-bromophenyl)ethyl]-2-nitro-5-piperazin-1-ylaniline Traditional Name: 1-(3-bromophenyl)ethyl-(2-nitro-5-piperazino-phenyl)amine Formula: C18H21BrN4O2 MolecularWeight: 405.28894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21BrN4O2/c1-13(14-3-2-4-15(19)11-14)21-17-12-16(5-6-18(17)23(24)25)22-9-7-20-8-10-22/h2-6,11-13,20-21H,7-10H2,1H3