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

Systemtic Name: 3-[[2-(2-azanyl-1,3-thiazol-4-yl)-2-formamido-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[2-(2-aminothiazol-4-yl)-2-formamido-acetyl]amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[2-(2-amino-4-thiazolyl)-2-formamido-1-oxoethyl]amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-(2-amino-1,3-thiazol-4-yl)-2-formamidoacetyl]amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[2-(2-aminothiazol-4-yl)-2-formamido-acetyl]amino]-2-carbomethoxy-4-keto-azetidine-1-sulfonic acid Formula: C11H13N5O8S2 MolecularWeight: 407.37962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CSC(=N2)N)NC=O

Isomeric SMILES

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CSC(=N2)N)NC=O

InChI

InChI=1S/C11H13N5O8S2/c1-24-10(20)7-6(9(19)16(7)26(21,22)23)15-8(18)5(13-3-17)4-2-25-11(12)14-4/h2-3,5-7H,1H3,(H2,12,14)(H,13,17)(H,15,18)(H,21,22,23)