(3R)-3-[(2S,4S)-2-ethyl-2-methyl-oxan-4-yl]-3-(4-fluorophenyl)propanoate

Systemtic Name: (3R)-3-[(2S,4S)-2-ethyl-2-methyl-oxan-4-yl]-3-(4-fluorophenyl)propanoate Openeye Name: (3R)-3-[(2S,4S)-2-ethyl-2-methyl-tetrahydropyran-4-yl]-3-(4-fluorophenyl)propanoate CAS Name: (3R)-3-[(2S,4S)-2-ethyl-2-methyl-4-oxanyl]-3-(4-fluorophenyl)propanoate IUPAC Name: (3R)-3-[(2S,4S)-2-ethyl-2-methyloxan-4-yl]-3-(4-fluorophenyl)propanoate Traditional Name: (3R)-3-[(2S,4S)-2-ethyl-2-methyl-tetrahydropyran-4-yl]-3-(4-fluorophenyl)propionate Formula: C17H22FO3- MolecularWeight: 293.353183

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)C(CC(=O)[O-])C2=CC=C(C=C2)F)C

Isomeric SMILES

CC[C@]1(C[C@H](CCO1)[C@@H](CC(=O)[O-])C2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H23FO3/c1-3-17(2)11-13(8-9-21-17)15(10-16(19)20)12-4-6-14(18)7-5-12/h4-7,13,15H,3,8-11H2,1-2H3,(H,19,20)/p-1/t13-,15-,17-/m0/s1