methyl 2-(5-cyano-2-oxidanyl-phenyl)-2-methyl-propanoate

Systemtic Name: methyl 2-(5-cyano-2-oxidanyl-phenyl)-2-methyl-propanoate Openeye Name: methyl 2-(5-cyano-2-hydroxy-phenyl)-2-methyl-propanoate CAS Name: 2-(5-cyano-2-hydroxyphenyl)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-(5-cyano-2-hydroxyphenyl)-2-methylpropanoate Traditional Name: 2-(5-cyano-2-hydroxy-phenyl)-2-methyl-propionic acid methyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-12(2,11(15)16-3)9-6-8(7-13)4-5-10(9)14/h4-6,14H,1-3H3