3-azanylpropanoic acid; 3,3-dimethyl-2,4-bis(oxidanyl)butanoic acid

Systemtic Name: 3-azanylpropanoic acid; 3,3-dimethyl-2,4-bis(oxidanyl)butanoic acid Openeye Name: 3-aminopropanoic acid; 2,4-dihydroxy-3,3-dimethyl-butanoic acid CAS Name: 3-aminopropanoic acid; 2,4-dihydroxy-3,3-dimethylbutanoic acid IUPAC Name: 3-aminopropanoic acid; 2,4-dihydroxy-3,3-dimethylbutanoic acid Traditional Name: 3-aminopropionic acid; 2,4-dihydroxy-3,3-dimethyl-butyric acid Formula: C9H19NO6 MolecularWeight: 237.25026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C(C(=O)O)O.C(CN)C(=O)O

Isomeric SMILES

CC(C)(CO)C(C(=O)O)O.C(CN)C(=O)O

InChI

InChI=1S/C6H12O4.C3H7NO2/c1-6(2,3-7)4(8)5(9)10;4-2-1-3(5)6/h4,7-8H,3H2,1-2H3,(H,9,10);1-2,4H2,(H,5,6)