1-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Openeye Name: 1-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide CAS Name: 1-(3,4-dimethoxyphenyl)-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Traditional Name: 1-(3,4-dimethoxyphenyl)-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-4-21(24)23-10-9-16-6-7-18(12-17(16)13-23)22-29(25,26)14-15-5-8-19(27-2)20(11-15)28-3/h5-8,11-12,22H,4,9-10,13-14H2,1-3H3