ethyl 4-(cyanomethyl)-2-oxidanyl-benzoate

Systemtic Name: ethyl 4-(cyanomethyl)-2-oxidanyl-benzoate Openeye Name: ethyl 4-(cyanomethyl)-2-hydroxy-benzoate CAS Name: 4-(cyanomethyl)-2-hydroxybenzoic acid ethyl ester IUPAC Name: ethyl 4-(cyanomethyl)-2-hydroxybenzoate Traditional Name: 4-(cyanomethyl)-2-hydroxy-benzoic acid ethyl ester Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO3/c1-2-15-11(14)9-4-3-8(5-6-12)7-10(9)13/h3-4,7,13H,2,5H2,1H3