ethyl 2-ethanoyl-5-[4-[[2-(4-fluorophenyl)phenyl]methylidene]piperidin-1-yl]pentanoate

Systemtic Name: ethyl 2-ethanoyl-5-[4-[[2-(4-fluorophenyl)phenyl]methylidene]piperidin-1-yl]pentanoate Openeye Name: ethyl 2-acetyl-5-[4-[[2-(4-fluorophenyl)phenyl]methylene]-1-piperidyl]pentanoate CAS Name: 2-acetyl-5-[4-[[2-(4-fluorophenyl)phenyl]methylidene]-1-piperidinyl]pentanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-5-[4-[[2-(4-fluorophenyl)phenyl]methylidene]piperidin-1-yl]pentanoate Traditional Name: 2-acetyl-5-[4-[2-(4-fluorophenyl)benzylidene]piperidino]valeric acid ethyl ester Formula: C27H32FNO3 MolecularWeight: 437.546283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCN1CCC(=CC2=CC=CC=C2C3=CC=C(C=C3)F)CC1)C(=O)C

Isomeric SMILES

CCOC(=O)C(CCCN1CCC(=CC2=CC=CC=C2C3=CC=C(C=C3)F)CC1)C(=O)C

InChI

InChI=1S/C27H32FNO3/c1-3-32-27(31)25(20(2)30)9-6-16-29-17-14-21(15-18-29)19-23-7-4-5-8-26(23)22-10-12-24(28)13-11-22/h4-5,7-8,10-13,19,25H,3,6,9,14-18H2,1-2H3