methyl 4-azanyl-5-cyano-1-oxidanyl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: methyl 4-azanyl-5-cyano-1-oxidanyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: methyl 4-amino-5-cyano-1-hydroxy-cyclohexa-2,4-diene-1-carboxylate CAS Name: 4-amino-5-cyano-1-hydroxy-1-cyclohexa-2,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-cyano-1-hydroxycyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-amino-5-cyano-1-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid methyl ester Formula: C9H10N2O3 MolecularWeight: 194.1873

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O3/c1-14-8(12)9(13)3-2-7(11)6(4-9)5-10/h2-3,13H,4,11H2,1H3