methyl 4-azanyl-5-cyano-2-oxidanyl-benzoate

Systemtic Name: methyl 4-azanyl-5-cyano-2-oxidanyl-benzoate Openeye Name: methyl 4-amino-5-cyano-2-hydroxy-benzoate CAS Name: 4-amino-5-cyano-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-amino-5-cyano-2-hydroxybenzoate Traditional Name: 4-amino-5-cyano-2-hydroxy-benzoic acid methyl ester Formula: C9H8N2O3 MolecularWeight: 192.17142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C(=C1)C#N)N)O

Isomeric SMILES

COC(=O)C1=C(C=C(C(=C1)C#N)N)O

InChI

InChI=1S/C9H8N2O3/c1-14-9(13)6-2-5(4-10)7(11)3-8(6)12/h2-3,12H,11H2,1H3