3-(aminocarbonyloxymethyl)-7-azido-7-bromanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(aminocarbonyloxymethyl)-7-azido-7-bromanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-azido-7-bromo-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-azido-7-bromo-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-azido-7-bromo-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-azido-7-bromo-3-(carbamoyloxymethyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C9H8BrN5O5S MolecularWeight: 378.15932

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)(N=[N+]=[N-])Br)C(=O)O)COC(=O)N

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)(N=[N+]=[N-])Br)C(=O)O)COC(=O)N

InChI

InChI=1S/C9H8BrN5O5S/c10-9(13-14-12)6(18)15-4(5(16)17)3(1-20-8(11)19)2-21-7(9)15/h7H,1-2H2,(H2,11,19)(H,16,17)