methyl 3-azanyl-6-cyano-2-oxidanyl-benzoate

Systemtic Name: methyl 3-azanyl-6-cyano-2-oxidanyl-benzoate Openeye Name: methyl 3-amino-6-cyano-2-hydroxy-benzoate CAS Name: 3-amino-6-cyano-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-amino-6-cyano-2-hydroxybenzoate Traditional Name: 3-amino-6-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=CC(=C1O)N)C#N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1O)N)C#N

InChI

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