N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-(2,5-dimethoxyphenyl)-3,4-dimethoxy-benzenesulfonamide Formula: C27H30N2O7S MolecularWeight: 526.6013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H30N2O7S/c1-33-21-9-11-24(34-2)23(15-21)29(37(31,32)22-10-12-25(35-3)26(16-22)36-4)18-27(30)28-14-13-19-7-5-6-8-20(19)17-28/h5-12,15-16H,13-14,17-18H2,1-4H3