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

Systemtic Name: [3-(bromomethyl)-2-carboxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylidene-azanium Openeye Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-isopropylidene-ammonium CAS Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylideneammonium IUPAC Name: [3-(bromomethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-propan-2-ylideneazanium Traditional Name: [3-(bromomethyl)-2-carboxy-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-isopropylidene-ammonium Formula: C11H14BrN2O3S+ MolecularWeight: 334.20946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrN2O3S/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)/p+1