butyl 1-[3,5-bis(trifluoromethyl)phenyl]-4-(ethenoxymethyl)-4-phenyl-piperidine-2-carboxylate

Systemtic Name: butyl 1-[3,5-bis(trifluoromethyl)phenyl]-4-(ethenoxymethyl)-4-phenyl-piperidine-2-carboxylate Openeye Name: butyl 1-[3,5-bis(trifluoromethyl)phenyl]-4-phenyl-4-(vinyloxymethyl)piperidine-2-carboxylate CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-4-(ethenoxymethyl)-4-phenyl-2-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 1-[3,5-bis(trifluoromethyl)phenyl]-4-(ethenoxymethyl)-4-phenylpiperidine-2-carboxylate Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-4-phenyl-4-(vinyloxymethyl)pipecolinic acid butyl ester Formula: C27H29F6NO3 MolecularWeight: 529.514479

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC(CCN1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(COC=C)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1CC(CCN1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(COC=C)C3=CC=CC=C3

InChI

InChI=1S/C27H29F6NO3/c1-3-5-13-37-24(35)23-17-25(18-36-4-2,19-9-7-6-8-10-19)11-12-34(23)22-15-20(26(28,29)30)14-21(16-22)27(31,32)33/h4,6-10,14-16,23H,2-3,5,11-13,17-18H2,1H3