ethyl 5-phenyl-1,2-oxazol-2-ium-3-sulfonate

Systemtic Name: ethyl 5-phenyl-1,2-oxazol-2-ium-3-sulfonate Openeye Name: ethyl 5-phenylisoxazol-2-ium-3-sulfonate CAS Name: 5-phenyl-3-isoxazol-2-iumsulfonic acid ethyl ester IUPAC Name: ethyl 5-phenyl-1,2-oxazol-2-ium-3-sulfonate Traditional Name: 5-phenylisoxazol-2-ium-3-sulfonic acid ethyl ester Formula: C11H12NO4S+ MolecularWeight: 254.28228

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C1=[NH+]OC(=C1)C2=CC=CC=C2

Isomeric SMILES

CCOS(=O)(=O)C1=[NH+]OC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C11H11NO4S/c1-2-15-17(13,14)11-8-10(16-12-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3/p+1