3-[6-[(4-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propanoic acid

Systemtic Name: 3-[6-[(4-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propanoic acid Openeye Name: 3-[6-[(4-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propanoic acid CAS Name: 3-[6-[(4-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methylpropanoic acid IUPAC Name: 3-[6-[(4-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-methylpropanoic acid Traditional Name: 3-[6-(4-fluorobenzyl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propionic acid Formula: C20H22FNO3 MolecularWeight: 343.391983

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC2=C(C1)C=CC(=C2)OCC3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(CN1CCC2=C(C1)C=CC(=C2)OCC3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H22FNO3/c1-14(20(23)24)11-22-9-8-16-10-19(7-4-17(16)12-22)25-13-15-2-5-18(21)6-3-15/h2-7,10,14H,8-9,11-13H2,1H3,(H,23,24)