2-[[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 2-[[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Openeye Name: 2-[[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]methyl]isoindolin-1-one CAS Name: 2-[[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 2-[[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Traditional Name: 2-[[1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidyl]methyl]isoindolin-1-one Formula: C24H27FN2O2 MolecularWeight: 394.481783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H27FN2O2/c25-21-9-7-19(8-10-21)23(28)6-3-13-26-14-11-18(12-15-26)16-27-17-20-4-1-2-5-22(20)24(27)29/h1-2,4-5,7-10,18H,3,6,11-17H2