N-[4-[1-(azepan-3-yl)hexoxy]phenyl]-4-bromanyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-[1-(azepan-3-yl)hexoxy]phenyl]-4-bromanyl-N-methyl-benzenesulfonamide Openeye Name: N-[4-[1-(azepan-3-yl)hexoxy]phenyl]-4-bromo-N-methyl-benzenesulfonamide CAS Name: N-[4-[1-(3-azepanyl)hexoxy]phenyl]-4-bromo-N-methylbenzenesulfonamide IUPAC Name: N-[4-[1-(azepan-3-yl)hexoxy]phenyl]-4-bromo-N-methylbenzenesulfonamide Traditional Name: N-[4-[1-(azepan-3-yl)hexoxy]phenyl]-4-bromo-N-methyl-benzenesulfonamide Formula: C25H35BrN2O3S MolecularWeight: 523.526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1CCCCNC1)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCC(C1CCCCNC1)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H35BrN2O3S/c1-3-4-5-9-25(20-8-6-7-18-27-19-20)31-23-14-12-22(13-15-23)28(2)32(29,30)24-16-10-21(26)11-17-24/h10-17,20,25,27H,3-9,18-19H2,1-2H3