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

Systemtic Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Openeye Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide IUPAC Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C13H18N2O3S/c1-3-13(16)15-7-6-10-4-5-12(8-11(10)9-15)14-19(2,17)18/h4-5,8,14H,3,6-7,9H2,1-2H3