methyl 3,3-dimethyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanidyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: methyl 3,3-dimethyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxidanidyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: methyl 6-(tert-butoxycarbonylamino)-3,3-dimethyl-1-oxido-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3,3-dimethyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxido-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester IUPAC Name: methyl 3,3-dimethyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxido-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-(tert-butoxycarbonylamino)-7-keto-3,3-dimethyl-1-oxido-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester Formula: C14H22N2O6S MolecularWeight: 346.39928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C([N+]2(C(S1)C(C2=O)NC(=O)OC(C)(C)C)[O-])C(=O)OC)C

Isomeric SMILES

CC1(C([N+]2(C(S1)C(C2=O)NC(=O)OC(C)(C)C)[O-])C(=O)OC)C

InChI

InChI=1S/C14H22N2O6S/c1-13(2,3)22-12(19)15-7-9(17)16(20)8(11(18)21-6)14(4,5)23-10(7)16/h7-8,10H,1-6H3,(H,15,19)