3,3-dimethyl-6-(3-methyl-1-oxidanyl-2-oxidanylidene-3-phenoxy-butyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-6-(3-methyl-1-oxidanyl-2-oxidanylidene-3-phenoxy-butyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-(1-hydroxy-3-methyl-2-oxo-3-phenoxy-butyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-(1-hydroxy-3-methyl-2-oxo-3-phenoxybutyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-(1-hydroxy-3-methyl-2-oxo-3-phenoxybutyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-(1-hydroxy-2-keto-3-methyl-3-phenoxy-butyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C19H23NO6S MolecularWeight: 393.45402

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)C(C)(C)OC3=CC=CC=C3)O)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)C(C)(C)OC3=CC=CC=C3)O)C(=O)O)C

InChI

InChI=1S/C19H23NO6S/c1-18(2,26-10-8-6-5-7-9-10)14(22)12(21)11-15(23)20-13(17(24)25)19(3,4)27-16(11)20/h5-9,11-13,16,21H,1-4H3,(H,24,25)