[3-(bromomethyl)-2-carboxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylidene-azanium bromide

Systemtic Name: [3-(bromomethyl)-2-carboxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylidene-azanium bromide Openeye Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-isopropylidene-ammonium bromide CAS Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylideneammonium bromide IUPAC Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylideneazanium bromide Traditional Name: [3-(bromomethyl)-2-carboxy-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-isopropylidene-ammonium bromide Formula: C11H14Br2N2O3S MolecularWeight: 414.11346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[NH+]C1C2N(C1=O)C(=C(CS2)CBr)C(=O)O)C.[Br-]

Isomeric SMILES

CC(=[NH+]C1C2N(C1=O)C(=C(CS2)CBr)C(=O)O)C.[Br-]

InChI

InChI=1S/C11H13BrN2O3S.BrH/c1-5(2)13-7-9(15)14-8(11(16)17)6(3-12)4-18-10(7)14;/h7,10H,3-4H2,1-2H3,(H,16,17);1H