N-[2-(4-bromophenyl)sulfonylethyl]-3-nitro-aniline

Systemtic Name: N-[2-(4-bromophenyl)sulfonylethyl]-3-nitro-aniline Openeye Name: N-[2-(4-bromophenyl)sulfonylethyl]-3-nitro-aniline CAS Name: N-[2-(4-bromophenyl)sulfonylethyl]-3-nitroaniline IUPAC Name: N-[2-(4-bromophenyl)sulfonylethyl]-3-nitroaniline Traditional Name: 2-brosylethyl-(3-nitrophenyl)amine Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O4S/c15-11-4-6-14(7-5-11)22(20,21)9-8-16-12-2-1-3-13(10-12)17(18)19/h1-7,10,16H,8-9H2