3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoranyl-2-methyl-phenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]cyclohex-2-en-1-one

Systemtic Name: 3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoranyl-2-methyl-phenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]cyclohex-2-en-1-one Openeye Name: 3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoro-2-methyl-phenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]cyclohex-2-en-1-one CAS Name: 3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoro-2-methylphenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]-1-cyclohex-2-enone IUPAC Name: 3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoro-2-methylphenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]cyclohex-2-en-1-one Traditional Name: 3-[(3aS,6R,7R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-7-(4-fluoro-2-methyl-phenyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-2-yl]cyclohex-2-en-1-one Formula: C30H30F7NO3 MolecularWeight: 585.552922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2C3CN(CC3COC2OC(C)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=CC(=O)CCC5

Isomeric SMILES

CC1=C(C=CC(=C1)F)[C@@H]2[C@H](OC[C@H]3C2CN(C3)C4=CC(=O)CCC4)O[C@H](C)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C30H30F7NO3/c1-16-8-22(31)6-7-25(16)27-26-14-38(23-4-3-5-24(39)12-23)13-19(26)15-40-28(27)41-17(2)18-9-20(29(32,33)34)11-21(10-18)30(35,36)37/h6-12,17,19,26-28H,3-5,13-15H2,1-2H3/t17-,19+,26?,27+,28-/m1/s1