1,1-Dimethylethyl 4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinecarboxylate

CAS Registry Number®

306298-26-0

CAS Name

1,1-Dimethylethyl 4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinecarboxylate

Molecular Formula

C26H40F3N3O3

Molecular Mass

499.61

Cite this Page

1,1-Dimethylethyl 4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=306298-26-0 (retrieved 2024-11-25) (CAS RN: 306298-26-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H40F3N3O3/c1-19-17-31(25(5)11-13-30(14-12-25)23(33)35-24(2,3)4)15-16-32(19)22(18-34-6)20-7-9-21(10-8-20)26(27,28)29/h7-10,19,22H,11-18H2,1-6H3/t19-,22-/m0/s1

InChIKey

InChIKey=LABHEHCWUFFHCE-UGKGYDQZSA-N

SMILES

[C@@H](COC)(N1[C@@H](C)CN(CC1)C2(C)CCN(C(OC(C)(C)C)=O)CC2)C3=CC=C(C(F)(F)F)C=C3

Canonical SMILES

O=C(OC(C)(C)C)N1CCC(N2CCN(C(C3=CC=C(C=C3)C(F)(F)F)COC)C(C)C2)(C)CC1

Other Names for this Substance

  • 1-Piperidinecarboxylic acid, 4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinecarboxylate

CAS INSIGHTSTM
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