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

Systemtic Name: 6-[acetamido(phenyl)methyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[acetamido(phenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[acetamido(phenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[acetamido(phenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[acetamido(phenyl)methyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1C2N(C1=O)C(C(S2)(C)C)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(C1C2N(C1=O)C(C(S2)(C)C)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N2O4S/c1-9(20)18-12(10-7-5-4-6-8-10)11-14(21)19-13(16(22)23)17(2,3)24-15(11)19/h4-8,11-13,15H,1-3H3,(H,18,20)(H,22,23)