5-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2-[(2-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2-[(2-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 5-[2-(2-ethyl-1-piperidyl)-2-oxo-ethoxy]-2-[(2-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 5-[2-(2-ethyl-1-piperidinyl)-2-oxoethoxy]-2-[(2-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 5-[2-(2-ethylpiperidin-1-yl)-2-oxoethoxy]-2-[(2-fluorophenyl)methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 5-[2-(2-ethylpiperidino)-2-keto-ethoxy]-2-(2-fluorobenzyl)-3,4-dihydroisocarbostyril Formula: C25H29FN2O3 MolecularWeight: 424.507763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)COC2=CC=CC3=C2CCN(C3=O)CC4=CC=CC=C4F

Isomeric SMILES

CCC1CCCCN1C(=O)COC2=CC=CC3=C2CCN(C3=O)CC4=CC=CC=C4F

InChI

InChI=1S/C25H29FN2O3/c1-2-19-9-5-6-14-28(19)24(29)17-31-23-12-7-10-21-20(23)13-15-27(25(21)30)16-18-8-3-4-11-22(18)26/h3-4,7-8,10-12,19H,2,5-6,9,13-17H2,1H3