(4-oxidanyl-1-oxidanylidene-2H-isoquinolin-3-yl) hydrogen carbonate

Systemtic Name: (4-oxidanyl-1-oxidanylidene-2H-isoquinolin-3-yl) hydrogen carbonate Openeye Name: (4-hydroxy-1-oxo-2H-isoquinolin-3-yl) hydrogen carbonate CAS Name: carbonic acid (4-hydroxy-1-oxo-2H-isoquinolin-3-yl) ester IUPAC Name: (4-hydroxy-1-oxo-2H-isoquinolin-3-yl) hydrogen carbonate Traditional Name: carbonic acid (4-hydroxy-1-keto-2H-isoquinolin-3-yl) ester Formula: C10H7NO5 MolecularWeight: 221.16628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(NC2=O)OC(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(NC2=O)OC(=O)O)O

InChI

InChI=1S/C10H7NO5/c12-7-5-3-1-2-4-6(5)8(13)11-9(7)16-10(14)15/h1-4,12H,(H,11,13)(H,14,15)