tert-butyl 6-acetamido-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylate

Systemtic Name: tert-butyl 6-acetamido-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylate Openeye Name: tert-butyl 6-acetamido-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylate CAS Name: 6-acetamido-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-acetamido-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylate Traditional Name: 6-acetamido-7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid tert-butyl ester Formula: C14H23N2O4S+ MolecularWeight: 315.40842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2[N+](C1=O)(CC(S2)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NC1C2[N+](C1=O)(CC(S2)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H22N2O4S/c1-8(17)15-9-10(18)16(12(19)20-13(2,3)4)7-14(5,6)21-11(9)16/h9,11H,7H2,1-6H3/p+1