1-bromanyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide

Systemtic Name: 1-bromanyl-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide Openeye Name: 1-bromo-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide CAS Name: 1-bromo-N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide IUPAC Name: 1-bromo-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]methanesulfonamide Traditional Name: 1-bromo-N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)methanesulfonamide Formula: C14H19BrN2O3S MolecularWeight: 375.28126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CBr

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)CBr

InChI

InChI=1S/C14H19BrN2O3S/c1-10(2)14(18)17-6-5-11-3-4-13(7-12(11)8-17)16-21(19,20)9-15/h3-4,7,10,16H,5-6,8-9H2,1-2H3