3-(bromomethyl)-7-(4-methylpentylideneamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(bromomethyl)-7-(4-methylpentylideneamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(bromomethyl)-7-(4-methylpentylideneamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(bromomethyl)-7-(4-methylpentylideneamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(bromomethyl)-7-(4-methylpentylideneamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(bromomethyl)-8-keto-7-(4-methylpentylideneamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C14H19BrN2O3S MolecularWeight: 375.28126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC=NC1C2N(C1=O)C(=C(CS2)CBr)C(=O)O

Isomeric SMILES

CC(C)CCC=NC1C2N(C1=O)C(=C(CS2)CBr)C(=O)O

InChI

InChI=1S/C14H19BrN2O3S/c1-8(2)4-3-5-16-10-12(18)17-11(14(19)20)9(6-15)7-21-13(10)17/h5,8,10,13H,3-4,6-7H2,1-2H3,(H,19,20)