7-azanyl-4-(bromomethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride

Systemtic Name: 7-azanyl-4-(bromomethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride Openeye Name: 7-amino-4-(bromomethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride CAS Name: 7-amino-4-(bromomethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride IUPAC Name: 7-amino-4-(bromomethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride Traditional Name: 7-amino-4-(bromomethyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride Formula: C8H9BrClN2O3S- MolecularWeight: 328.59066

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N2C(C(C2=O)N)SC1CBr)C(=O)[O-].Cl

Isomeric SMILES

C1=C(N2C(C(C2=O)N)SC1CBr)C(=O)[O-].Cl

InChI

InChI=1S/C8H9BrN2O3S.ClH/c9-2-3-1-4(8(13)14)11-6(12)5(10)7(11)15-3;/h1,3,5,7H,2,10H2,(H,13,14);1H/p-1