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

Systemtic Name: 3,3-dimethyl-6-[2-(4-methylphenyl)-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[1-hydroxy-2-oxo-2-(p-tolyl)ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[1-hydroxy-2-(4-methylphenyl)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[1-hydroxy-2-(4-methylphenyl)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[1-hydroxy-2-keto-2-(p-tolyl)ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C2C3N(C2=O)C(C(S3)(C)C)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C2C3N(C2=O)C(C(S3)(C)C)C(=O)O)O

InChI

InChI=1S/C17H19NO5S/c1-8-4-6-9(7-5-8)11(19)12(20)10-14(21)18-13(16(22)23)17(2,3)24-15(10)18/h4-7,10,12-13,15,20H,1-3H3,(H,22,23)