4-cyano-4-(3-methoxyphenyl)-3,3-dimethyl-butanoic acid

Systemtic Name: 4-cyano-4-(3-methoxyphenyl)-3,3-dimethyl-butanoic acid Openeye Name: 4-cyano-4-(3-methoxyphenyl)-3,3-dimethyl-butanoic acid CAS Name: 4-cyano-4-(3-methoxyphenyl)-3,3-dimethylbutanoic acid IUPAC Name: 4-cyano-4-(3-methoxyphenyl)-3,3-dimethylbutanoic acid Traditional Name: 4-cyano-4-(3-methoxyphenyl)-3,3-dimethyl-butyric acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)C(C#N)C1=CC(=CC=C1)OC

Isomeric SMILES

CC(C)(CC(=O)O)C(C#N)C1=CC(=CC=C1)OC

InChI

InChI=1S/C14H17NO3/c1-14(2,8-13(16)17)12(9-15)10-5-4-6-11(7-10)18-3/h4-7,12H,8H2,1-3H3,(H,16,17)