N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-benzyl-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-2,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-benzyl-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-benzyl-2,5-dimethoxy-benzenesulfonamide Formula: C23H30N2O5S MolecularWeight: 446.5597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O5S/c1-29-20-12-13-21(30-2)22(16-20)31(27,28)25(17-19-10-6-5-7-11-19)18-23(26)24-14-8-3-4-9-15-24/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3