(2R)-3-[3-chloranyl-4-(2-methylpropoxy)phenyl]-2-cyano-propanoate

Systemtic Name: (2R)-3-[3-chloranyl-4-(2-methylpropoxy)phenyl]-2-cyano-propanoate Openeye Name: (2R)-3-(3-chloro-4-isobutoxy-phenyl)-2-cyano-propanoate CAS Name: (2R)-3-[3-chloro-4-(2-methylpropoxy)phenyl]-2-cyanopropanoate IUPAC Name: (2R)-3-[3-chloro-4-(2-methylpropoxy)phenyl]-2-cyanopropanoate Traditional Name: (2R)-3-(3-chloro-4-isobutoxy-phenyl)-2-cyano-propionate Formula: C14H15ClNO3- MolecularWeight: 280.7268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CC(C#N)C(=O)[O-])Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C[C@H](C#N)C(=O)[O-])Cl

InChI

InChI=1S/C14H16ClNO3/c1-9(2)8-19-13-4-3-10(6-12(13)15)5-11(7-16)14(17)18/h3-4,6,9,11H,5,8H2,1-2H3,(H,17,18)/p-1/t11-/m1/s1