[(1R,3R,4R,6S)-4,7,7-trimethyl-4-oxidanyl-3-bicyclo[4.1.0]heptanyl] (2R)-2-fluoranyl-2-[4-(2-methylpropyl)phenyl]propanoate

Systemtic Name: [(1R,3R,4R,6S)-4,7,7-trimethyl-4-oxidanyl-3-bicyclo[4.1.0]heptanyl] (2R)-2-fluoranyl-2-[4-(2-methylpropyl)phenyl]propanoate Openeye Name: [(1R,3R,4R,6S)-4-hydroxy-4,7,7-trimethyl-norcaran-3-yl] (2R)-2-fluoro-2-(4-isobutylphenyl)propanoate CAS Name: (2R)-2-fluoro-2-[4-(2-methylpropyl)phenyl]propanoic acid [(1R,3R,4R,6S)-4-hydroxy-4,7,7-trimethyl-3-bicyclo[4.1.0]heptanyl] ester IUPAC Name: [(1R,3R,4R,6S)-4-hydroxy-4,7,7-trimethyl-3-bicyclo[4.1.0]heptanyl] (2R)-2-fluoro-2-[4-(2-methylpropyl)phenyl]propanoate Traditional Name: (2R)-2-fluoro-2-(4-isobutylphenyl)propionic acid [(1R,3R,4R,6S)-4-hydroxy-4,7,7-trimethyl-norcaran-3-yl] ester Formula: C23H33FO3 MolecularWeight: 376.504723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)(C(=O)OC2CC3C(C3(C)C)CC2(C)O)F

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)[C@](C)(C(=O)O[C@@H]2C[C@@H]3[C@@H](C3(C)C)C[C@@]2(C)O)F

InChI

InChI=1S/C23H33FO3/c1-14(2)11-15-7-9-16(10-8-15)23(6,24)20(25)27-19-12-17-18(21(17,3)4)13-22(19,5)26/h7-10,14,17-19,26H,11-13H2,1-6H3/t17-,18+,19-,22-,23-/m1/s1