ethyl (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyl-oxan-4-yl]ethanoate

Systemtic Name: ethyl (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyl-oxan-4-yl]ethanoate Openeye Name: ethyl (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyl-tetrahydropyran-4-yl]acetate CAS Name: (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyl-4-oxanyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]acetate Traditional Name: (2S)-2-cyano-2-[(2R,4R)-2-ethyl-4-(4-fluorophenyl)-2-methyl-tetrahydropyran-4-yl]acetic acid ethyl ester Formula: C19H24FNO3 MolecularWeight: 333.397163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(C2=CC=C(C=C2)F)C(C#N)C(=O)OCC)C

Isomeric SMILES

CC[C@@]1(C[C@@](CCO1)(C2=CC=C(C=C2)F)[C@@H](C#N)C(=O)OCC)C

InChI

InChI=1S/C19H24FNO3/c1-4-18(3)13-19(10-11-24-18,14-6-8-15(20)9-7-14)16(12-21)17(22)23-5-2/h6-9,16H,4-5,10-11,13H2,1-3H3/t16-,18+,19-/m0/s1