2-[[1-(cyclooctylmethyl)piperidin-4-yl]methyl]-5,6-diethoxy-2-fluoranyl-3H-inden-1-one

Systemtic Name: 2-[[1-(cyclooctylmethyl)piperidin-4-yl]methyl]-5,6-diethoxy-2-fluoranyl-3H-inden-1-one Openeye Name: 2-[[1-(cyclooctylmethyl)-4-piperidyl]methyl]-5,6-diethoxy-2-fluoro-indan-1-one CAS Name: 2-[[1-(cyclooctylmethyl)-4-piperidinyl]methyl]-5,6-diethoxy-2-fluoro-3H-inden-1-one IUPAC Name: 2-[[1-(cyclooctylmethyl)piperidin-4-yl]methyl]-5,6-diethoxy-2-fluoro-3H-inden-1-one Traditional Name: 2-[[1-(cyclooctylmethyl)-4-piperidyl]methyl]-5,6-diethoxy-2-fluoro-indan-1-one Formula: C28H42FNO3 MolecularWeight: 459.636383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(C2=O)(CC3CCN(CC3)CC4CCCCCCC4)F)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(C2=O)(CC3CCN(CC3)CC4CCCCCCC4)F)OCC

InChI

InChI=1S/C28H42FNO3/c1-3-32-25-16-23-19-28(29,27(31)24(23)17-26(25)33-4-2)18-21-12-14-30(15-13-21)20-22-10-8-6-5-7-9-11-22/h16-17,21-22H,3-15,18-20H2,1-2H3