1-(8-chloranyl-7-methylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 1-(8-chloranyl-7-methylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 1-(8-chloro-7-methylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-(8-chloro-7-methylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 1-(8-chloro-7-methylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 1-(8-chloro-7-mesyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C(=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C(=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C12H14ClNO3S/c1-8(15)14-6-5-9-3-4-11(18(2,16)17)12(13)10(9)7-14/h3-4H,5-7H2,1-2H3