2-(carboxymethylsulfanyl)-4-isocyanato-2-(2-isocyanatoethyl)butanoic acid

Systemtic Name: 2-(carboxymethylsulfanyl)-4-isocyanato-2-(2-isocyanatoethyl)butanoic acid Openeye Name: 2-(carboxymethylsulfanyl)-4-isocyanato-2-(2-isocyanatoethyl)butanoic acid CAS Name: 2-(carboxymethylthio)-4-isocyanato-2-(2-isocyanatoethyl)butanoic acid IUPAC Name: 2-(carboxymethylsulfanyl)-4-isocyanato-2-(2-isocyanatoethyl)butanoic acid Traditional Name: 2-(carboxymethylthio)-4-isocyanato-2-(2-isocyanatoethyl)butyric acid Formula: C10H12N2O6S MolecularWeight: 288.27708

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Descriptors Computed from Structure

Canonical SMILES:

C(CN=C=O)C(CCN=C=O)(C(=O)O)SCC(=O)O

Isomeric SMILES

C(CN=C=O)C(CCN=C=O)(C(=O)O)SCC(=O)O

InChI

InChI=1S/C10H12N2O6S/c13-6-11-3-1-10(9(17)18,2-4-12-7-14)19-5-8(15)16/h1-5H2,(H,15,16)(H,17,18)