ethyl 2-azanyl-1,4-bis(oxidanyl)quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1,4-bis(oxidanyl)quinolin-1-ium-3-carboxylate Openeye Name: ethyl 2-amino-1,4-dihydroxy-quinolin-1-ium-3-carboxylate CAS Name: 2-amino-1,4-dihydroxy-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1,4-dihydroxyquinolin-1-ium-3-carboxylate Traditional Name: 2-amino-1,4-dihydroxy-quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C12H13N2O4+ MolecularWeight: 249.24262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2[N+](=C1N)O)O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2[N+](=C1N)O)O

InChI

InChI=1S/C12H12N2O4/c1-2-18-12(16)9-10(15)7-5-3-4-6-8(7)14(17)11(9)13/h3-6,17H,2H2,1H3,(H2,13,15,16)/p+1