2-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[1-(2-chloro-3-pyridinyl)-2-pyrrolyl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[1-(2-chloropyridin-3-yl)pyrrol-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CC=CN3C4=C(N=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CC=CN3C4=C(N=CC=C4)Cl)OC

InChI

InChI=1S/C21H22ClN3O2/c1-26-19-11-15-7-10-24(13-16(15)12-20(19)27-2)14-17-5-4-9-25(17)18-6-3-8-23-21(18)22/h3-6,8-9,11-12H,7,10,13-14H2,1-2H3