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

Systemtic Name: 1-(chloromethyl)-6,7-dimethoxy-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzenesulfonyl)-1-(chloromethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-(benzenesulfonyl)-1-(chloromethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzenesulfonyl)-1-(chloromethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-besyl-1-(chloromethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO4S/c1-23-17-10-13-8-9-20(16(12-19)15(13)11-18(17)24-2)25(21,22)14-6-4-3-5-7-14/h3-7,10-11,16H,8-9,12H2,1-2H3