sodium 3-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-ethoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: sodium 3-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-ethoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: sodium 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-ethoxycarbonyl-4-oxo-azetidine-1-sulfonate CAS Name: sodium 3-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-ethoxycarbonyl-4-oxo-1-azetidinesulfonate IUPAC Name: sodium 3-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-ethoxycarbonyl-4-oxoazetidine-1-sulfonate Traditional Name: sodium 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-carbethoxy-4-keto-azetidine-1-sulfonate Formula: C12H14N5NaO8S2 MolecularWeight: 443.38803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)C(=NOC)C2=CSC(=N2)N.[Na+]

Isomeric SMILES

CCOC(=O)C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)/C(=N/OC)/C2=CSC(=N2)N.[Na+]

InChI

InChI=1S/C12H15N5O8S2.Na/c1-3-25-11(20)8-7(10(19)17(8)27(21,22)23)15-9(18)6(16-24-2)5-4-26-12(13)14-5;/h4,7-8H,3H2,1-2H3,(H2,13,14)(H,15,18)(H,21,22,23);/q;+1/p-1/b16-6+;