5-butoxy-2-[(4-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5-butoxy-2-[(4-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5-butoxy-2-[(4-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 5-butoxy-2-[(4-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5-butoxy-2-[(4-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5-butoxy-2-(4-fluorobenzyl)-3,4-dihydroisocarbostyril Formula: C20H22FNO2 MolecularWeight: 327.392583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC2=C1CCN(C2=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCCCOC1=CC=CC2=C1CCN(C2=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FNO2/c1-2-3-13-24-19-6-4-5-18-17(19)11-12-22(20(18)23)14-15-7-9-16(21)10-8-15/h4-10H,2-3,11-14H2,1H3