2-[bis(carboxymethyl)amino]-3-[2-oxidanylidene-2-(2-oxidanylpropylamino)ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-[bis(carboxymethyl)amino]-3-[2-oxidanylidene-2-(2-oxidanylpropylamino)ethyl]sulfanyl-propanoic acid Openeye Name: 2-[bis(carboxymethyl)amino]-3-[2-(2-hydroxypropylamino)-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-[bis(carboxymethyl)amino]-3-[[2-(2-hydroxypropylamino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[bis(carboxymethyl)amino]-3-[2-(2-hydroxypropylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[bis(carboxymethyl)amino]-3-[[2-(2-hydroxypropylamino)-2-keto-ethyl]thio]propionic acid Formula: C12H20N2O8S MolecularWeight: 352.3608

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSCC(C(=O)O)N(CC(=O)O)CC(=O)O)O

Isomeric SMILES

CC(CNC(=O)CSCC(C(=O)O)N(CC(=O)O)CC(=O)O)O

InChI

InChI=1S/C12H20N2O8S/c1-7(15)2-13-9(16)6-23-5-8(12(21)22)14(3-10(17)18)4-11(19)20/h7-8,15H,2-6H2,1H3,(H,13,16)(H,17,18)(H,19,20)(H,21,22)