ethyl 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-oxo-pentanoate CAS Name: 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-oxopentanoate Traditional Name: 5-[1-(2-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-5-keto-valeric acid ethyl ester Formula: C22H24FNO3 MolecularWeight: 369.429263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(=O)N1CCC2=CC=CC=C2C1C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)CCCC(=O)N1CCC2=CC=CC=C2C1C3=CC=CC=C3F

InChI

InChI=1S/C22H24FNO3/c1-2-27-21(26)13-7-12-20(25)24-15-14-16-8-3-4-9-17(16)22(24)18-10-5-6-11-19(18)23/h3-6,8-11,22H,2,7,12-15H2,1H3