2-[6-[(3-fluorophenyl)methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]propanoic acid

Systemtic Name: 2-[6-[(3-fluorophenyl)methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]propanoic acid Openeye Name: 2-[6-[(3-fluorophenyl)methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]propanoic acid CAS Name: 2-[6-[(3-fluorophenyl)methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]propanoic acid IUPAC Name: 2-[6-[(3-fluorophenyl)methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]propanoic acid Traditional Name: 2-[6-(3-fluorobenzyl)oxy-1-keto-3,4-dihydroisoquinolin-2-yl]propionic acid Formula: C19H18FNO4 MolecularWeight: 343.348923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCC2=C(C1=O)C=CC(=C2)OCC3=CC(=CC=C3)F

Isomeric SMILES

CC(C(=O)O)N1CCC2=C(C1=O)C=CC(=C2)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C19H18FNO4/c1-12(19(23)24)21-8-7-14-10-16(5-6-17(14)18(21)22)25-11-13-3-2-4-15(20)9-13/h2-6,9-10,12H,7-8,11H2,1H3,(H,23,24)