methyl 2-methyl-5-phenyl-1,2-oxazol-2-ium-3-carboxylate

Systemtic Name: methyl 2-methyl-5-phenyl-1,2-oxazol-2-ium-3-carboxylate Openeye Name: methyl 2-methyl-5-phenyl-isoxazol-2-ium-3-carboxylate CAS Name: 2-methyl-5-phenyl-3-isoxazol-2-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-phenyl-1,2-oxazol-2-ium-3-carboxylate Traditional Name: 2-methyl-5-phenyl-isoxazol-2-ium-3-carboxylic acid methyl ester Formula: C12H12NO3+ MolecularWeight: 218.22858

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(O1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

C[N+]1=C(C=C(O1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C12H12NO3/c1-13-10(12(14)15-2)8-11(16-13)9-6-4-3-5-7-9/h3-8H,1-2H3/q+1