tert-butyl (4S,6S,7R)-7-azanyl-4-methyl-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl (4S,6S,7R)-7-azanyl-4-methyl-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl (4S,6S,7R)-7-amino-4-methyl-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (4S,6S,7R)-7-amino-4-methyl-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S,6S,7R)-7-amino-4-methyl-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (4S,6S,7R)-7-amino-8-keto-4-methyl-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C(C(=O)N2C(=C1)C(=O)OC(C)(C)C)N

Isomeric SMILES

C[C@H]1C[C@H]2[C@H](C(=O)N2C(=C1)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C13H20N2O3/c1-7-5-8-10(14)11(16)15(8)9(6-7)12(17)18-13(2,3)4/h6-8,10H,5,14H2,1-4H3/t7-,8-,10+/m0/s1