[7,8-bis(chloranyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone

Systemtic Name: [7,8-bis(chloranyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone Openeye Name: (7,8-dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-(2-isopropoxy-5-methylsulfonyl-phenyl)methanone CAS Name: (7,8-dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone IUPAC Name: (7,8-dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone Traditional Name: (7,8-dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-(2-isopropoxy-5-mesyl-phenyl)methanone Formula: C20H21Cl2NO4S MolecularWeight: 442.35604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCC3=C(C2)C(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCC3=C(C2)C(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H21Cl2NO4S/c1-12(2)27-18-7-5-14(28(3,25)26)10-15(18)20(24)23-9-8-13-4-6-17(21)19(22)16(13)11-23/h4-7,10,12H,8-9,11H2,1-3H3