3-[[(2E)-2-(2-azaniumyl-1,3-thiazol-4-yl)-2-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyimino-ethanoyl]amino]-2-methyl-4-oxidanylidene-azetidine-1-sulfonate; 2,6-bis(azanyl)hexanoic acid; sulfuric acid

Systemtic Name: 3-[[(2E)-2-(2-azaniumyl-1,3-thiazol-4-yl)-2-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyimino-ethanoyl]amino]-2-methyl-4-oxidanylidene-azetidine-1-sulfonate; 2,6-bis(azanyl)hexanoic acid; sulfuric acid Openeye Name: 3-[[(2E)-2-(2-azaniumylthiazol-4-yl)-2-(2-hydroxy-1,1-dimethyl-2-oxo-ethoxy)imino-acetyl]amino]-2-methyl-4-oxo-azetidine-1-sulfonate; 2,6-diaminohexanoic acid; sulfuric acid CAS Name: 3-[[(2E)-2-(2-ammonio-4-thiazolyl)-2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyimino-1-oxoethyl]amino]-2-methyl-4-oxo-1-azetidinesulfonate; 2,6-diaminohexanoic acid; sulfuric acid IUPAC Name: 3-[[(2E)-2-(2-azaniumyl-1,3-thiazol-4-yl)-2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxyiminoacetyl]amino]-2-methyl-4-oxoazetidine-1-sulfonate; 2,6-diaminohexanoic acid; sulfuric acid Traditional Name: 3-[[(2E)-2-(2-ammoniothiazol-4-yl)-2-(2-hydroxy-2-keto-1,1-dimethyl-ethyl)oximino-acetyl]amino]-2-keto-4-methyl-azetidine-1-sulfonate; 2,6-diaminohexanoic acid; sulfuric acid Formula: C19H33N7O14S3 MolecularWeight: 679.69882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N1S(=O)(=O)[O-])NC(=O)C(=NOC(C)(C)C(=O)O)C2=CSC(=N2)[NH3+].C(CCN)CC(C(=O)O)N.OS(=O)(=O)O

Isomeric SMILES

CC1C(C(=O)N1S(=O)(=O)[O-])NC(=O)/C(=N/OC(C)(C)C(=O)O)/C2=CSC(=N2)[NH3+].C(CCN)CC(C(=O)O)N.OS(=O)(=O)O

InChI

InChI=1S/C13H17N5O8S2.C6H14N2O2.H2O4S/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22;7-4-2-1-3-5(8)6(9)10;1-5(2,3)4/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25);5H,1-4,7-8H2,(H,9,10);(H2,1,2,3,4)/b17-8+;;