sodium 3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-butoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: sodium 3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-butoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: sodium 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-butoxyimino-acetyl]amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonate CAS Name: sodium 3-[[(2Z)-2-(2-amino-4-thiazolyl)-2-butoxyimino-1-oxoethyl]amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonate IUPAC Name: sodium 3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-butoxyiminoacetyl]amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonate Traditional Name: sodium 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-butyloximino-acetyl]amino]-2-carbomethoxy-4-keto-azetidine-1-sulfonate Formula: C14H18N5NaO8S2 MolecularWeight: 471.44119

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Descriptors Computed from Structure

Canonical SMILES:

CCCCON=C(C1=CSC(=N1)N)C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])C(=O)OC.[Na+]

Isomeric SMILES

CCCCO/N=C(/C1=CSC(=N1)N)\C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])C(=O)OC.[Na+]

InChI

InChI=1S/C14H19N5O8S2.Na/c1-3-4-5-27-18-8(7-6-28-14(15)16-7)11(20)17-9-10(13(22)26-2)19(12(9)21)29(23,24)25;/h6,9-10H,3-5H2,1-2H3,(H2,15,16)(H,17,20)(H,23,24,25);/q;+1/p-1/b18-8-;