6-azaniumyl-5-oxidanyl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 6-azaniumyl-5-oxidanyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: 6-azaniumyl-5-hydroxy-cyclohexa-2,4-diene-1-carboxylate CAS Name: 6-ammonio-5-hydroxy-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 6-azaniumyl-5-hydroxycyclohexa-2,4-diene-1-carboxylate Traditional Name: 6-ammonio-5-hydroxy-cyclohexa-2,4-diene-1-carboxylate Formula: C7H9NO3 MolecularWeight: 155.15126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(C(=C1)O)[NH3+])C(=O)[O-]

Isomeric SMILES

C1=CC(C(C(=C1)O)[NH3+])C(=O)[O-]

InChI

InChI=1S/C7H9NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-4,6,9H,8H2,(H,10,11)