N-(3-bromanylpropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide

Systemtic Name: N-(3-bromanylpropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide Openeye Name: N-(3-bromopropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide CAS Name: N-(3-bromopropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide IUPAC Name: N-(3-bromopropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide Traditional Name: N-(3-bromopropyl)-4-methyl-N-(4-nitrophenyl)benzenesulfonamide Formula: C16H17BrN2O4S MolecularWeight: 413.28618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN2O4S/c1-13-3-9-16(10-4-13)24(22,23)18(12-2-11-17)14-5-7-15(8-6-14)19(20)21/h3-10H,2,11-12H2,1H3