1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline

Systemtic Name: 1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Openeye Name: 1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline CAS Name: 1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline IUPAC Name: 1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Traditional Name: 1-[3,5-bis(trifluoromethyl)benzyl]-6,7-dimethoxy-3,4-dihydroisoquinoline Formula: C20H17F6NO2 MolecularWeight: 417.344899

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)OC

InChI

InChI=1S/C20H17F6NO2/c1-28-17-8-12-3-4-27-16(15(12)10-18(17)29-2)7-11-5-13(19(21,22)23)9-14(6-11)20(24,25)26/h5-6,8-10H,3-4,7H2,1-2H3