3-[[(2E)-2-(2-azanyl-5-chloranyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[[(2E)-2-(2-azanyl-5-chloranyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[(2E)-2-(2-amino-5-chloro-thiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[(2E)-2-(2-amino-5-chloro-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[(2E)-2-(2-amino-5-chloro-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[(2E)-2-(2-amino-5-chloro-thiazol-4-yl)-2-methyloximino-acetyl]amino]-2-carbomethoxy-4-keto-azetidine-1-sulfonic acid Formula: C11H12ClN5O8S2 MolecularWeight: 441.82468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(=NOC)C2=C(SC(=N2)N)Cl

Isomeric SMILES

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)/C(=N/OC)/C2=C(SC(=N2)N)Cl

InChI

InChI=1S/C11H12ClN5O8S2/c1-24-10(20)6-5(9(19)17(6)27(21,22)23)14-8(18)4(16-25-2)3-7(12)26-11(13)15-3/h5-6H,1-2H3,(H2,13,15)(H,14,18)(H,21,22,23)/b16-4+