3-[2-(methylamino)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]propanoate

Systemtic Name: 3-[2-(methylamino)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]propanoate Openeye Name: 3-[2-(methylamino)-4,5-dihydrothiazol-3-ium-3-yl]propanoate CAS Name: 3-[2-(methylamino)-4,5-dihydrothiazol-3-ium-3-yl]propanoate IUPAC Name: 3-[2-(methylamino)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]propanoate Traditional Name: 3-[2-(methylamino)-2-thiazolin-3-ium-3-yl]propionate Formula: C7H12N2O2S MolecularWeight: 188.24738

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=[N+](CCS1)CCC(=O)[O-]

Isomeric SMILES

CNC1=[N+](CCS1)CCC(=O)[O-]

InChI

InChI=1S/C7H12N2O2S/c1-8-7-9(4-5-12-7)3-2-6(10)11/h2-5H2,1H3,(H,10,11)