methyl 3-(2-cyanophenyl)-2,2-dimethoxy-propanoate

Systemtic Name: methyl 3-(2-cyanophenyl)-2,2-dimethoxy-propanoate Openeye Name: methyl 3-(2-cyanophenyl)-2,2-dimethoxy-propanoate CAS Name: 3-(2-cyanophenyl)-2,2-dimethoxypropanoic acid methyl ester IUPAC Name: methyl 3-(2-cyanophenyl)-2,2-dimethoxypropanoate Traditional Name: 3-(2-cyanophenyl)-2,2-dimethoxy-propionic acid methyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1C#N)(OC)OC

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1C#N)(OC)OC

InChI

InChI=1S/C13H15NO4/c1-16-12(15)13(17-2,18-3)8-10-6-4-5-7-11(10)9-14/h4-7H,8H2,1-3H3