2,2-dimethylpropane-1,3-diol; hexanedioic acid; 3-sulfanylpropanoic acid

Systemtic Name: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 3-sulfanylpropanoic acid Openeye Name: adipic acid; 2,2-dimethylpropane-1,3-diol; 3-sulfanylpropanoic acid CAS Name: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 3-mercaptopropanoic acid IUPAC Name: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 3-sulfanylpropanoic acid Traditional Name: adipic acid; 2,2-dimethylpropane-1,3-diol; 3-mercaptopropionic acid Formula: C14H28O8S MolecularWeight: 356.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O.C(CS)C(=O)O

Isomeric SMILES

CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O.C(CS)C(=O)O

InChI

InChI=1S/C6H10O4.C5H12O2.C3H6O2S/c7-5(8)3-1-2-4-6(9)10;1-5(2,3-6)4-7;4-3(5)1-2-6/h1-4H2,(H,7,8)(H,9,10);6-7H,3-4H2,1-2H3;6H,1-2H2,(H,4,5)