(4S)-2-pyridin-1-ium-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylate

Systemtic Name: (4S)-2-pyridin-1-ium-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylate Openeye Name: (4S)-2-pyridin-1-ium-3-yl-4,5-dihydrothiazole-4-carboxylate CAS Name: (4S)-2-(3-pyridin-1-iumyl)-4,5-dihydrothiazole-4-carboxylate IUPAC Name: (4S)-2-pyridin-1-ium-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylate Traditional Name: (4S)-2-pyridin-1-ium-3-yl-2-thiazoline-4-carboxylate Formula: C9H8N2O2S MolecularWeight: 208.23702

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(S1)C2=C[NH+]=CC=C2)C(=O)[O-]

Isomeric SMILES

C1[C@@H](N=C(S1)C2=C[NH+]=CC=C2)C(=O)[O-]

InChI

InChI=1S/C9H8N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7H,5H2,(H,12,13)/t7-/m1/s1