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

Systemtic Name: 2-(aziridin-1-yl)propanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol Openeye Name: 2-(aziridin-1-yl)propanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol CAS Name: 2-(1-aziridinyl)propanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: 2-(aziridin-1-yl)propanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol Traditional Name: 2-ethyleniminopropionic acid; 2-ethyl-2-methylol-propane-1,3-diol Formula: C21H41N3O9 MolecularWeight: 479.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)CO.CC(C(=O)O)N1CC1.CC(C(=O)O)N1CC1.CC(C(=O)O)N1CC1

Isomeric SMILES

CCC(CO)(CO)CO.CC(C(=O)O)N1CC1.CC(C(=O)O)N1CC1.CC(C(=O)O)N1CC1

InChI

InChI=1S/C6H14O3.3C5H9NO2/c1-2-6(3-7,4-8)5-9;3*1-4(5(7)8)6-2-3-6/h7-9H,2-5H2,1H3;3*4H,2-3H2,1H3,(H,7,8)