methyl 5-(4,5-dimethyl-3-oxidanidyl-1,3-oxazol-3-ium-2-yl)thiophene-2-carboxylate

Systemtic Name: methyl 5-(4,5-dimethyl-3-oxidanidyl-1,3-oxazol-3-ium-2-yl)thiophene-2-carboxylate Openeye Name: methyl 5-(4,5-dimethyl-3-oxido-oxazol-3-ium-2-yl)thiophene-2-carboxylate CAS Name: 5-(4,5-dimethyl-3-oxido-2-oxazol-3-iumyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4,5-dimethyl-3-oxido-1,3-oxazol-3-ium-2-yl)thiophene-2-carboxylate Traditional Name: 5-(4,5-dimethyl-3-oxido-oxazol-3-ium-2-yl)thiophene-2-carboxylic acid methyl ester Formula: C11H11NO4S MolecularWeight: 253.27434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=[N+]1[O-])C2=CC=C(S2)C(=O)OC)C

Isomeric SMILES

CC1=C(OC(=[N+]1[O-])C2=CC=C(S2)C(=O)OC)C

InChI

InChI=1S/C11H11NO4S/c1-6-7(2)16-10(12(6)14)8-4-5-9(17-8)11(13)15-3/h4-5H,1-3H3