methyl 4-[4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-piperidin-1-yl]butanoate

Systemtic Name: methyl 4-[4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-piperidin-1-yl]butanoate Openeye Name: methyl 4-[4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-1-piperidyl]butanoate CAS Name: 4-[4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-phenyl-1-piperidinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-4-phenylpiperidin-1-yl]butanoate Traditional Name: 4-[4-[[3,5-bis(trifluoromethyl)benzyl]oxymethyl]-4-phenyl-piperidino]butyric acid methyl ester Formula: C26H29F6NO3 MolecularWeight: 517.503779

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1CCC(CC1)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCN1CCC(CC1)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C26H29F6NO3/c1-35-23(34)8-5-11-33-12-9-24(10-13-33,20-6-3-2-4-7-20)18-36-17-19-14-21(25(27,28)29)16-22(15-19)26(30,31)32/h2-4,6-7,14-16H,5,8-13,17-18H2,1H3