6,7-dimethoxy-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[5-(1-piperidylsulfonyl)-2-pyridyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[5-(1-piperidinylsulfonyl)-2-pyridinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-(5-piperidinosulfonyl-2-pyridyl)-3,4-dihydro-1H-isoquinoline Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3=NC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C3=NC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

InChI

InChI=1S/C21H27N3O4S/c1-27-19-12-16-8-11-23(15-17(16)13-20(19)28-2)21-7-6-18(14-22-21)29(25,26)24-9-4-3-5-10-24/h6-7,12-14H,3-5,8-11,15H2,1-2H3