methyl 5-chloranyl-9-oxidanidyl-[1,3]oxazolo[4,5-h]quinolin-9-ium-2-carboxylate

Systemtic Name: methyl 5-chloranyl-9-oxidanidyl-[1,3]oxazolo[4,5-h]quinolin-9-ium-2-carboxylate Openeye Name: methyl 5-chloro-9-oxido-oxazolo[4,5-h]quinolin-9-ium-2-carboxylate CAS Name: 5-chloro-9-oxido-2-oxazolo[4,5-h]quinolin-9-iumcarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-9-oxido-[1,3]oxazolo[4,5-h]quinolin-9-ium-2-carboxylate Traditional Name: 5-chloro-9-oxido-oxazolo[4,5-h]quinolin-9-ium-2-carboxylic acid methyl ester Formula: C12H7ClN2O4 MolecularWeight: 278.64798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=CC(=C3C=CC=[N+](C3=C2O1)[O-])Cl

Isomeric SMILES

COC(=O)C1=NC2=CC(=C3C=CC=[N+](C3=C2O1)[O-])Cl

InChI

InChI=1S/C12H7ClN2O4/c1-18-12(16)11-14-8-5-7(13)6-3-2-4-15(17)9(6)10(8)19-11/h2-5H,1H3