4-[3-[(2-butanoylphenoxy)methyl]piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[3-[(2-butanoylphenoxy)methyl]piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[3-[(2-butanoylphenoxy)methyl]-1-piperidyl]-1-(4-fluorophenyl)butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[3-[[2-(1-oxobutyl)phenoxy]methyl]-1-piperidinyl]-1-butanone IUPAC Name: 4-[3-[(2-butanoylphenoxy)methyl]piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[3-[(2-butyrylphenoxy)methyl]piperidino]-1-(4-fluorophenyl)butan-1-one Formula: C26H32FNO3 MolecularWeight: 425.535583

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=CC=C1OCC2CCCN(C2)CCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC(=O)C1=CC=CC=C1OCC2CCCN(C2)CCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C26H32FNO3/c1-2-7-25(30)23-9-3-4-11-26(23)31-19-20-8-5-16-28(18-20)17-6-10-24(29)21-12-14-22(27)15-13-21/h3-4,9,11-15,20H,2,5-8,10,16-19H2,1H3