7-[(2-bromanyl-2-phenyl-ethanoyl)amino]-3-(2-bromoethyl)-5,8-bis(oxidanylidene)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[(2-bromanyl-2-phenyl-ethanoyl)amino]-3-(2-bromoethyl)-5,8-bis(oxidanylidene)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(2-bromoethyl)-7-[(2-bromo-2-phenyl-acetyl)amino]-5,8-dioxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(2-bromoethyl)-7-[(2-bromo-1-oxo-2-phenylethyl)amino]-5,8-dioxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(2-bromoethyl)-7-[(2-bromo-2-phenylacetyl)amino]-5,8-dioxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(2-bromoethyl)-7-[(2-bromo-2-phenyl-acetyl)amino]-5,8-diketo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C17H16Br2N2O5S MolecularWeight: 520.19234

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1=O)C(C2=O)NC(=O)C(C3=CC=CC=C3)Br)C(=O)O)CCBr

Isomeric SMILES

C1C(=C(N2C(S1=O)C(C2=O)NC(=O)C(C3=CC=CC=C3)Br)C(=O)O)CCBr

InChI

InChI=1S/C17H16Br2N2O5S/c18-7-6-10-8-27(26)16-12(15(23)21(16)13(10)17(24)25)20-14(22)11(19)9-4-2-1-3-5-9/h1-5,11-12,16H,6-8H2,(H,20,22)(H,24,25)