1-[(6-chloranylpyridin-3-yl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline

Systemtic Name: 1-[(6-chloranylpyridin-3-yl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Openeye Name: 1-[(6-chloro-3-pyridyl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline CAS Name: 1-[(6-chloro-3-pyridinyl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline IUPAC Name: 1-[(6-chloropyridin-3-yl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Traditional Name: 1-[(6-chloro-3-pyridyl)sulfonylmethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CS(=O)(=O)C3=CN=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CS(=O)(=O)C3=CN=C(C=C3)Cl)OC

InChI

InChI=1S/C17H17ClN2O4S/c1-23-15-7-11-5-6-19-14(13(11)8-16(15)24-2)10-25(21,22)12-3-4-17(18)20-9-12/h3-4,7-9H,5-6,10H2,1-2H3