N-[3-(azepan-1-yl)propyl]-3-bromanyl-4-methoxy-benzenesulfonamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-3-bromanyl-4-methoxy-benzenesulfonamide Openeye Name: N-[3-(azepan-1-yl)propyl]-3-bromo-4-methoxy-benzenesulfonamide CAS Name: N-[3-(1-azepanyl)propyl]-3-bromo-4-methoxybenzenesulfonamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-3-bromo-4-methoxybenzenesulfonamide Traditional Name: N-[3-(azepan-1-yl)propyl]-3-bromo-4-methoxy-benzenesulfonamide Formula: C16H25BrN2O3S MolecularWeight: 405.3503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCCCCC2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCN2CCCCCC2)Br

InChI

InChI=1S/C16H25BrN2O3S/c1-22-16-8-7-14(13-15(16)17)23(20,21)18-9-6-12-19-10-4-2-3-5-11-19/h7-8,13,18H,2-6,9-12H2,1H3