4-[(2-tert-butyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-en-2-yl)carbonyloxymethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-tert-butyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-en-2-yl)carbonyloxymethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2-tert-butyl-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carbonyl)oxymethoxy]-4-oxo-butanoic acid CAS Name: 4-[[(2-tert-butyl-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-en-2-yl)-oxomethoxy]methoxy]-4-oxobutanoic acid IUPAC Name: 4-[(2-tert-butyl-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carbonyl)oxymethoxy]-4-oxobutanoic acid Traditional Name: 4-[(2-tert-butyl-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carbonyl)oxymethoxy]-4-keto-butyric acid Formula: C17H23NO8S MolecularWeight: 401.43142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C=CSC2N1C(=O)C2OC)C(=O)OCOC(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1(C=CSC2N1C(=O)C2OC)C(=O)OCOC(=O)CCC(=O)O

InChI

InChI=1S/C17H23NO8S/c1-16(2,3)17(7-8-27-14-12(24-4)13(22)18(14)17)15(23)26-9-25-11(21)6-5-10(19)20/h7-8,12,14H,5-6,9H2,1-4H3,(H,19,20)