(2S,4S)-4-(1,3-thiazol-4-ylmethyl)pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2S,4S)-4-(1,3-thiazol-4-ylmethyl)pyrrolidin-1-ium-2-carboxylate Openeye Name: (2S,4S)-4-(thiazol-4-ylmethyl)pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4S)-4-(4-thiazolylmethyl)-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2S,4S)-4-(1,3-thiazol-4-ylmethyl)pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4S)-4-(thiazol-4-ylmethyl)pyrrolidin-1-ium-2-carboxylate Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)[O-])CC2=CSC=N2

Isomeric SMILES

C1[C@H](C[NH2+][C@@H]1C(=O)[O-])CC2=CSC=N2

InChI

InChI=1S/C9H12N2O2S/c12-9(13)8-2-6(3-10-8)1-7-4-14-5-11-7/h4-6,8,10H,1-3H2,(H,12,13)/t6-,8+/m1/s1