N-[(3,4-dimethoxyphenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3,4-dimethoxy-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3,4-dimethoxy-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3,4-dimethoxy-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-(2-ketoazepan-3-yl)-3,4-dimethoxy-N-veratryl-benzenesulfonamide Formula: C23H30N2O7S MolecularWeight: 478.5585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C23H30N2O7S/c1-29-19-10-8-16(13-21(19)31-3)15-25(18-7-5-6-12-24-23(18)26)33(27,28)17-9-11-20(30-2)22(14-17)32-4/h8-11,13-14,18H,5-7,12,15H2,1-4H3,(H,24,26)