methyl (3S)-3-cyano-3-(4-fluorophenyl)propanoate

Systemtic Name: methyl (3S)-3-cyano-3-(4-fluorophenyl)propanoate Openeye Name: methyl (3S)-3-cyano-3-(4-fluorophenyl)propanoate CAS Name: (3S)-3-cyano-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl (3S)-3-cyano-3-(4-fluorophenyl)propanoate Traditional Name: (3S)-3-cyano-3-(4-fluorophenyl)propionic acid methyl ester Formula: C11H10FNO2 MolecularWeight: 207.201003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C#N)C1=CC=C(C=C1)F

Isomeric SMILES

COC(=O)C[C@H](C#N)C1=CC=C(C=C1)F

InChI

InChI=1S/C11H10FNO2/c1-15-11(14)6-9(7-13)8-2-4-10(12)5-3-8/h2-5,9H,6H2,1H3/t9-/m1/s1