(2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate

Systemtic Name: (2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate Openeye Name: (2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate CAS Name: (2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate IUPAC Name: (2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate Traditional Name: (2S,5R)-2-carboxy-6-diazonio-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]hept-6-en-7-olate Formula: C8H9N3O3S MolecularWeight: 227.24036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(=C2[O-])[N+]#N)C(=O)O)C

Isomeric SMILES

CC1([C@@H](N2[C@H](S1)C(=C2[O-])[N+]#N)C(=O)O)C

InChI

InChI=1S/C8H9N3O3S/c1-8(2)4(7(13)14)11-5(12)3(10-9)6(11)15-8/h4,6H,1-2H3,(H-,12,13,14)/t4-,6+/m0/s1