2-[2-[(3R)-2,5-bis(oxidanylidene)-3-piperidin-1-ium-1-yl-pyrrolidin-1-yl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[(3R)-2,5-bis(oxidanylidene)-3-piperidin-1-ium-1-yl-pyrrolidin-1-yl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[(3R)-2,5-dioxo-3-piperidin-1-ium-1-yl-pyrrolidin-1-yl]thiazol-4-yl]acetate CAS Name: 2-[2-[(3R)-2,5-dioxo-3-(1-piperidin-1-iumyl)-1-pyrrolidinyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[(3R)-2,5-dioxo-3-piperidin-1-ium-1-ylpyrrolidin-1-yl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(3R)-2,5-diketo-3-piperidin-1-ium-1-yl-pyrrolidino]thiazol-4-yl]acetate Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=NC(=CS3)CC(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)[C@@H]2CC(=O)N(C2=O)C3=NC(=CS3)CC(=O)[O-]

InChI

InChI=1S/C14H17N3O4S/c18-11-7-10(16-4-2-1-3-5-16)13(21)17(11)14-15-9(8-22-14)6-12(19)20/h8,10H,1-7H2,(H,19,20)/t10-/m1/s1