1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-2-cyclopentyl-7-methoxy-1H-isoquinoline dihydrochloride

Systemtic Name: 1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-2-cyclopentyl-7-methoxy-1H-isoquinoline dihydrochloride Openeye Name: 2-cyclopentyl-1-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-1H-isoquinoline dihydrochloride CAS Name: 2-cyclopentyl-1-[(3,5-dichloro-4-pyridinyl)methyl]-7-methoxy-1H-isoquinoline dihydrochloride IUPAC Name: 2-cyclopentyl-1-[(3,5-dichloropyridin-4-yl)methyl]-7-methoxy-1H-isoquinoline dihydrochloride Traditional Name: 2-cyclopentyl-1-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-1H-isoquinoline dihydrochloride Formula: C21H24Cl4N2O MolecularWeight: 462.24006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CN(C2CC3=C(C=NC=C3Cl)Cl)C4CCCC4.Cl.Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C=CN(C2CC3=C(C=NC=C3Cl)Cl)C4CCCC4.Cl.Cl

InChI

InChI=1S/C21H22Cl2N2O.2ClH/c1-26-16-7-6-14-8-9-25(15-4-2-3-5-15)21(17(14)10-16)11-18-19(22)12-24-13-20(18)23;;/h6-10,12-13,15,21H,2-5,11H2,1H3;2*1H