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

Systemtic Name: 2-[6-[(3-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[6-[(3-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-acetic acid CAS Name: 2-[6-[(3-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoacetic acid IUPAC Name: 2-[6-[(3-fluorophenyl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoacetic acid Traditional Name: 2-[6-(3-fluorobenzyl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-keto-acetic acid Formula: C18H16FNO4 MolecularWeight: 329.322343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=C(C=C2)OCC3=CC(=CC=C3)F)C(=O)C(=O)O

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)OCC3=CC(=CC=C3)F)C(=O)C(=O)O

InChI

InChI=1S/C18H16FNO4/c19-15-3-1-2-12(8-15)11-24-16-5-4-14-10-20(17(21)18(22)23)7-6-13(14)9-16/h1-5,8-9H,6-7,10-11H2,(H,22,23)