1-[(1R)-1-[(4-fluoranylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one

Systemtic Name: 1-[(1R)-1-[(4-fluoranylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one Openeye Name: 1-[(1R)-1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one CAS Name: 1-[(1R)-1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-1-butanone IUPAC Name: 1-[(1R)-1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one Traditional Name: 1-[(1R)-1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one Formula: C22H26FNO4 MolecularWeight: 387.444543

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=C(C=C3)F)OC)OC

Isomeric SMILES

CCCC(=O)N1CCC2=CC(=C(C=C2[C@@H]1COC3=CC=C(C=C3)F)OC)OC

InChI

InChI=1S/C22H26FNO4/c1-4-5-22(25)24-11-10-15-12-20(26-2)21(27-3)13-18(15)19(24)14-28-17-8-6-16(23)7-9-17/h6-9,12-13,19H,4-5,10-11,14H2,1-3H3/t19-/m0/s1