2-bromanyl-4-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide Openeye Name: 2-bromo-4-methyl-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide CAS Name: 2-bromo-4-methyl-N-[3-(2-oxo-1-azepanyl)propyl]benzenesulfonamide IUPAC Name: 2-bromo-4-methyl-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide Traditional Name: 2-bromo-N-[3-(2-ketoazepan-1-yl)propyl]-4-methyl-benzenesulfonamide Formula: C16H23BrN2O3S MolecularWeight: 403.33442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCCCN2CCCCCC2=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCCCN2CCCCCC2=O)Br

InChI

InChI=1S/C16H23BrN2O3S/c1-13-7-8-15(14(17)12-13)23(21,22)18-9-5-11-19-10-4-2-3-6-16(19)20/h7-8,12,18H,2-6,9-11H2,1H3