6,7-dimethoxy-2-(phenylsulfonyl)-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-(phenylsulfonyl)-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-besyl-6,7-dimethoxy-1-(trichloromethyl)-3,4-dihydro-1H-isoquinoline Formula: C18H18Cl3NO4S MolecularWeight: 450.76382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=CC=C3)C(Cl)(Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=CC=C3)C(Cl)(Cl)Cl)OC

InChI

InChI=1S/C18H18Cl3NO4S/c1-25-15-10-12-8-9-22(27(23,24)13-6-4-3-5-7-13)17(18(19,20)21)14(12)11-16(15)26-2/h3-7,10-11,17H,8-9H2,1-2H3