2-[2-[[2-(bromomethyl)-1-[2-(carboxymethyloxy)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-azetidin-3-yl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[2-[[2-(bromomethyl)-1-[2-(carboxymethyloxy)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-azetidin-3-yl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[2-[[2-(bromomethyl)-1-[2-(carboxymethyloxy)-2-oxo-ethyl]sulfanyl-4-oxo-azetidin-3-yl]amino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[[2-(bromomethyl)-1-[[2-(carboxymethyloxy)-2-oxoethyl]thio]-4-oxo-3-azetidinyl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 2-[2-[[2-(bromomethyl)-1-[2-(carboxymethyloxy)-2-oxoethyl]sulfanyl-4-oxoazetidin-3-yl]amino]-2-oxoethyl]benzoic acid Traditional Name: 2-[2-[[2-(bromomethyl)-1-[[2-(carboxymethyloxy)-2-keto-ethyl]thio]-4-keto-azetidin-3-yl]amino]-2-keto-ethyl]benzoic acid Formula: C17H17BrN2O8S MolecularWeight: 489.29448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)NC2C(N(C2=O)SCC(=O)OCC(=O)O)CBr)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)NC2C(N(C2=O)SCC(=O)OCC(=O)O)CBr)C(=O)O

InChI

InChI=1S/C17H17BrN2O8S/c18-6-11-15(16(25)20(11)29-8-14(24)28-7-13(22)23)19-12(21)5-9-3-1-2-4-10(9)17(26)27/h1-4,11,15H,5-8H2,(H,19,21)(H,22,23)(H,26,27)