2-[carboxymethyl(diethylaminosulfanyl)amino]propane-1,2,3-tricarboxylic acid

Systemtic Name: 2-[carboxymethyl(diethylaminosulfanyl)amino]propane-1,2,3-tricarboxylic acid Openeye Name: 2-[carboxymethyl(diethylaminosulfanyl)amino]propane-1,2,3-tricarboxylic acid CAS Name: 2-[carboxymethyl-(diethylaminothio)amino]propane-1,2,3-tricarboxylic acid IUPAC Name: 2-[carboxymethyl(diethylaminosulfanyl)amino]propane-1,2,3-tricarboxylic acid Traditional Name: 2-[carboxymethyl-(diethylaminothio)amino]propane-1,2,3-tricarboxylic acid Formula: C12H20N2O8S MolecularWeight: 352.3608

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)SN(CC(=O)O)C(CC(=O)O)(CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)SN(CC(=O)O)C(CC(=O)O)(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H20N2O8S/c1-3-13(4-2)23-14(7-10(19)20)12(11(21)22,5-8(15)16)6-9(17)18/h3-7H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H,21,22)