7-azanyl-3-(2-bromanylpropoxycarbonyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-(2-bromanylpropoxycarbonyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-(2-bromopropoxycarbonyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[2-bromopropoxy(oxo)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-(2-bromopropoxycarbonyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-(2-bromopropoxycarbonyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C11H13BrN2O5S MolecularWeight: 365.20032

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=C(N2C(C(C2=O)N)SC1)C(=O)O)Br

Isomeric SMILES

CC(COC(=O)C1=C(N2C(C(C2=O)N)SC1)C(=O)O)Br

InChI

InChI=1S/C11H13BrN2O5S/c1-4(12)2-19-11(18)5-3-20-9-6(13)8(15)14(9)7(5)10(16)17/h4,6,9H,2-3,13H2,1H3,(H,16,17)