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

Systemtic Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC=C)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC=C)OC

InChI

InChI=1S/C21H24N2O5S/c1-4-9-22-29(25,26)18-7-5-6-16(11-18)21(24)23-10-8-15-12-19(27-2)20(28-3)13-17(15)14-23/h4-7,11-13,22H,1,8-10,14H2,2-3H3