4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-prop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-prop-1-enyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C27H28N2O6S/c1-33-23-9-7-22(8-10-23)28-36(31,32)24-11-4-19(5-12-24)6-13-27(30)29-15-14-20-16-25(34-2)26(35-3)17-21(20)18-29/h4-13,16-17,28H,14-15,18H2,1-3H3