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

Systemtic Name: methyl 4-azanyl-5-ethanoyl-1-oxidanyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: methyl 5-acetyl-4-amino-1-hydroxy-cyclohexa-2,4-diene-1-carboxylate CAS Name: 5-acetyl-4-amino-1-hydroxy-1-cyclohexa-2,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-4-amino-1-hydroxycyclohexa-2,4-diene-1-carboxylate Traditional Name: 5-acetyl-4-amino-1-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid methyl ester Formula: C10H13NO4 MolecularWeight: 211.21452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(C1)(C(=O)OC)O)N

Isomeric SMILES

CC(=O)C1=C(C=CC(C1)(C(=O)OC)O)N

InChI

InChI=1S/C10H13NO4/c1-6(12)7-5-10(14,9(13)15-2)4-3-8(7)11/h3-4,14H,5,11H2,1-2H3