2-[3-(2,5-dimethoxyphenyl)-3-(2-fluoranylphenoxy)propyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[3-(2,5-dimethoxyphenyl)-3-(2-fluoranylphenoxy)propyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[3-(2,5-dimethoxyphenyl)-3-(2-fluorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[3-(2,5-dimethoxyphenyl)-3-(2-fluorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[3-(2,5-dimethoxyphenyl)-3-(2-fluorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[3-(2,5-dimethoxyphenyl)-3-(2-fluorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline Formula: C26H28FNO3 MolecularWeight: 421.503823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(CCN2CCC3=CC=CC=C3C2)OC4=CC=CC=C4F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(CCN2CCC3=CC=CC=C3C2)OC4=CC=CC=C4F

InChI

InChI=1S/C26H28FNO3/c1-29-21-11-12-24(30-2)22(17-21)25(31-26-10-6-5-9-23(26)27)14-16-28-15-13-19-7-3-4-8-20(19)18-28/h3-12,17,25H,13-16,18H2,1-2H3