2,2-bis(hydroxymethyl)butyl 3-(aziridin-1-yl)propanoate

Systemtic Name: 2,2-bis(hydroxymethyl)butyl 3-(aziridin-1-yl)propanoate Openeye Name: 2,2-bis(hydroxymethyl)butyl 3-(aziridin-1-yl)propanoate CAS Name: 3-(1-aziridinyl)propanoic acid 2,2-bis(hydroxymethyl)butyl ester IUPAC Name: 2,2-bis(hydroxymethyl)butyl 3-(aziridin-1-yl)propanoate Traditional Name: 3-ethyleniminopropionic acid 2,2-dimethylolbutyl ester Formula: C11H21NO4 MolecularWeight: 231.28874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)COC(=O)CCN1CC1

Isomeric SMILES

CCC(CO)(CO)COC(=O)CCN1CC1

InChI

InChI=1S/C11H21NO4/c1-2-11(7-13,8-14)9-16-10(15)3-4-12-5-6-12/h13-14H,2-9H2,1H3