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

Systemtic Name: 3-[2-(methylamino)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]propanoic acid Openeye Name: 3-[2-(methylamino)-4,5-dihydrothiazol-3-ium-3-yl]propanoic acid CAS Name: 3-[2-(methylamino)-4,5-dihydrothiazol-3-ium-3-yl]propanoic acid IUPAC Name: 3-[2-(methylamino)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]propanoic acid Traditional Name: 3-[2-(methylamino)-2-thiazolin-3-ium-3-yl]propionic acid Formula: C7H13N2O2S+ MolecularWeight: 189.25532

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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)/p+1