3-(2-methyl-4,5-dihydro-1,3-oxazol-3-ium-3-yl)propane-1-sulfonate

Systemtic Name: 3-(2-methyl-4,5-dihydro-1,3-oxazol-3-ium-3-yl)propane-1-sulfonate Openeye Name: 3-(2-methyl-4,5-dihydrooxazol-3-ium-3-yl)propane-1-sulfonate CAS Name: 3-(2-methyl-4,5-dihydrooxazol-3-ium-3-yl)-1-propanesulfonate IUPAC Name: 3-(2-methyl-4,5-dihydro-1,3-oxazol-3-ium-3-yl)propane-1-sulfonate Traditional Name: 3-(2-methyl-2-oxazolin-3-ium-3-yl)propane-1-sulfonate Formula: C7H13NO4S MolecularWeight: 207.24742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCO1)CCCS(=O)(=O)[O-]

Isomeric SMILES

CC1=[N+](CCO1)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C7H13NO4S/c1-7-8(4-5-12-7)3-2-6-13(9,10)11/h2-6H2,1H3