2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(3-methylaziridin-2-yl)propanoic acid

Systemtic Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(3-methylaziridin-2-yl)propanoic acid Openeye Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(3-methylaziridin-2-yl)propanoic acid CAS Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(3-methyl-2-aziridinyl)propanoic acid IUPAC Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 2-(3-methylaziridin-2-yl)propanoic acid Traditional Name: 2-ethyl-2-methylol-propane-1,3-diol; 2-(3-methylethylenimin-2-yl)propionic acid Formula: C24H47N3O9 MolecularWeight: 521.64468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)CO.CC1C(N1)C(C)C(=O)O.CC1C(N1)C(C)C(=O)O.CC1C(N1)C(C)C(=O)O

Isomeric SMILES

CCC(CO)(CO)CO.CC1C(N1)C(C)C(=O)O.CC1C(N1)C(C)C(=O)O.CC1C(N1)C(C)C(=O)O

InChI

InChI=1S/3C6H11NO2.C6H14O3/c3*1-3(6(8)9)5-4(2)7-5;1-2-6(3-7,4-8)5-9/h3*3-5,7H,1-2H3,(H,8,9);7-9H,2-5H2,1H3