2-[[1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[[1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[[1-[2-(4-fluorophenyl)-2-oxo-ethyl]-4-piperidyl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[[1-[2-(4-fluorophenyl)-2-oxoethyl]-4-piperidinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[[1-[2-(4-fluorophenyl)-2-keto-ethyl]-4-piperidyl]methyl]-3,4-dihydroisocarbostyril Formula: C23H25FN2O2 MolecularWeight: 380.455203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCC3=CC=CC=C3C2=O)CC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1CN2CCC3=CC=CC=C3C2=O)CC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN2O2/c24-20-7-5-19(6-8-20)22(27)16-25-12-9-17(10-13-25)15-26-14-11-18-3-1-2-4-21(18)23(26)28/h1-8,17H,9-16H2