2-[[1-[(6-fluoranyl-1,2-benzoxazol-3-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 2-[[1-[(6-fluoranyl-1,2-benzoxazol-3-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Openeye Name: 2-[[1-[(6-fluoro-1,2-benzoxazol-3-yl)methyl]-4-piperidyl]methyl]isoindolin-1-one CAS Name: 2-[[1-[(6-fluoro-1,2-benzoxazol-3-yl)methyl]-4-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 2-[[1-[(6-fluoro-1,2-benzoxazol-3-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Traditional Name: 2-[[1-[(6-fluoroindoxazen-3-yl)methyl]-4-piperidyl]methyl]isoindolin-1-one Formula: C22H22FN3O2 MolecularWeight: 379.427383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=NOC5=C4C=CC(=C5)F

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=NOC5=C4C=CC(=C5)F

InChI

InChI=1S/C22H22FN3O2/c23-17-5-6-19-20(24-28-21(19)11-17)14-25-9-7-15(8-10-25)12-26-13-16-3-1-2-4-18(16)22(26)27/h1-6,11,15H,7-10,12-14H2