methyl 5-[cyano(oxidanyl)methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[cyano(oxidanyl)methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[cyano(hydroxy)methyl]-2-methoxy-benzoate CAS Name: 5-[cyano(hydroxy)methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[cyano(hydroxy)methyl]-2-methoxybenzoate Traditional Name: 5-[cyano(hydroxy)methyl]-2-methoxy-benzoic acid methyl ester Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)O)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)O)C(=O)OC

InChI

InChI=1S/C11H11NO4/c1-15-10-4-3-7(9(13)6-12)5-8(10)11(14)16-2/h3-5,9,13H,1-2H3