4-bromanyl-3-methyl-N-[2-[(4-nitrophenyl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-3-methyl-N-[2-[(4-nitrophenyl)amino]ethyl]benzenesulfonamide Openeye Name: 4-bromo-3-methyl-N-[2-(4-nitroanilino)ethyl]benzenesulfonamide CAS Name: 4-bromo-3-methyl-N-[2-(4-nitroanilino)ethyl]benzenesulfonamide IUPAC Name: 4-bromo-3-methyl-N-[2-(4-nitroanilino)ethyl]benzenesulfonamide Traditional Name: 4-bromo-3-methyl-N-[2-(4-nitroanilino)ethyl]benzenesulfonamide Formula: C15H16BrN3O4S MolecularWeight: 414.27424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H16BrN3O4S/c1-11-10-14(6-7-15(11)16)24(22,23)18-9-8-17-12-2-4-13(5-3-12)19(20)21/h2-7,10,17-18H,8-9H2,1H3