6,7-diethoxy-1-(2-fluoranyl-4-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-diethoxy-1-(2-fluoranyl-4-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6,7-diethoxy-1-(2-fluoro-4-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-diethoxy-1-(2-fluoro-4-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-diethoxy-1-(2-fluoro-4-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-diethoxy-1-(2-fluoro-4-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C20H24FNO3 MolecularWeight: 345.407863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=C(C=C(C=C3)OC)F)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=C(C=C(C=C3)OC)F)OCC

InChI

InChI=1S/C20H24FNO3/c1-4-24-18-10-13-8-9-22-20(16(13)12-19(18)25-5-2)15-7-6-14(23-3)11-17(15)21/h6-7,10-12,20,22H,4-5,8-9H2,1-3H3