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

Systemtic Name: sodium 3-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-butoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: sodium 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-butoxycarbonyl-4-oxo-azetidine-1-sulfonate CAS Name: sodium 3-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-[butoxy(oxo)methyl]-4-oxo-1-azetidinesulfonate IUPAC Name: sodium 3-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-butoxycarbonyl-4-oxoazetidine-1-sulfonate Traditional Name: sodium 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-butoxycarbonyl-4-keto-azetidine-1-sulfonate Formula: C14H18N5NaO8S2 MolecularWeight: 471.44119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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