6,7-bis(oxidanyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-3-carboxylate

Systemtic Name: 6,7-bis(oxidanyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-3-carboxylate Openeye Name: 6,7-dihydroxy-1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylate CAS Name: 6,7-dihydroxy-1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylate IUPAC Name: 6,7-dihydroxy-1-oxo-3,4-dihydro-2H-isoquinoline-3-carboxylate Traditional Name: 6,7-dihydroxy-1-keto-3,4-dihydro-2H-isoquinoline-3-carboxylate Formula: C10H8NO5- MolecularWeight: 222.17422

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C2=CC(=C(C=C21)O)O)C(=O)[O-]

Isomeric SMILES

C1C(NC(=O)C2=CC(=C(C=C21)O)O)C(=O)[O-]

InChI

InChI=1S/C10H9NO5/c12-7-2-4-1-6(10(15)16)11-9(14)5(4)3-8(7)13/h2-3,6,12-13H,1H2,(H,11,14)(H,15,16)/p-1