2-oxidanylidene-3-[2-(2-sulfophenyl)ethanoylamino]azetidine-1-sulfonic acid

Systemtic Name: 2-oxidanylidene-3-[2-(2-sulfophenyl)ethanoylamino]azetidine-1-sulfonic acid Openeye Name: 2-oxo-3-[[2-(2-sulfophenyl)acetyl]amino]azetidine-1-sulfonic acid CAS Name: 2-oxo-3-[[1-oxo-2-(2-sulfophenyl)ethyl]amino]-1-azetidinesulfonic acid IUPAC Name: 2-oxo-3-[[2-(2-sulfophenyl)acetyl]amino]azetidine-1-sulfonic acid Traditional Name: 2-keto-3-[[2-(2-sulfophenyl)acetyl]amino]azetidine-1-sulfonic acid Formula: C11H12N2O8S2 MolecularWeight: 364.35158

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)O)NC(=O)CC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)O)NC(=O)CC2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C11H12N2O8S2/c14-10(12-8-6-13(11(8)15)23(19,20)21)5-7-3-1-2-4-9(7)22(16,17)18/h1-4,8H,5-6H2,(H,12,14)(H,16,17,18)(H,19,20,21)