methyl 1-methyl-3-oxidanidyl-9bH-[1,2]oxazolo[4,3-f]quinolin-3-ium-1-carboxylate

Systemtic Name: methyl 1-methyl-3-oxidanidyl-9bH-[1,2]oxazolo[4,3-f]quinolin-3-ium-1-carboxylate Openeye Name: methyl 1-methyl-3-oxido-9bH-isoxazolo[4,3-f]quinolin-3-ium-1-carboxylate CAS Name: 1-methyl-3-oxido-9bH-isoxazolo[4,3-f]quinolin-3-ium-1-carboxylic acid methyl ester IUPAC Name: methyl 1-methyl-3-oxido-9bH-[1,2]oxazolo[4,3-f]quinolin-3-ium-1-carboxylate Traditional Name: 1-methyl-3-oxido-9bH-isoxazolo[4,3-f]quinolin-3-ium-1-carboxylic acid methyl ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C3=C(C=CC2=[N+](O1)[O-])N=CC=C3)C(=O)OC

Isomeric SMILES

CC1(C2C3=C(C=CC2=[N+](O1)[O-])N=CC=C3)C(=O)OC

InChI

InChI=1S/C13H12N2O4/c1-13(12(16)18-2)11-8-4-3-7-14-9(8)5-6-10(11)15(17)19-13/h3-7,11H,1-2H3