butyl 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanyl-ethoxy]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: butyl 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanyl-ethoxy]-2-phenyl-piperidine-1-carboxylate Openeye Name: butyl 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxy-ethoxy]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxyethoxy]-2-phenyl-1-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxyethoxy]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[1-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxy-ethoxy]-2-phenyl-piperidine-1-carboxylic acid butyl ester Formula: C26H29F6NO4 MolecularWeight: 533.503179

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCCC(C1C2=CC=CC=C2)OC(CO)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCOC(=O)N1CCCC(C1C2=CC=CC=C2)OC(CO)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H29F6NO4/c1-2-3-12-36-24(35)33-11-7-10-21(23(33)17-8-5-4-6-9-17)37-22(16-34)18-13-19(25(27,28)29)15-20(14-18)26(30,31)32/h4-6,8-9,13-15,21-23,34H,2-3,7,10-12,16H2,1H3