methyl 3-[2-(aziridin-1-yl)ethyl-(3-methoxy-3-oxidanylidene-propyl)amino]propanoate

Systemtic Name: methyl 3-[2-(aziridin-1-yl)ethyl-(3-methoxy-3-oxidanylidene-propyl)amino]propanoate Openeye Name: methyl 3-[2-(aziridin-1-yl)ethyl-(3-methoxy-3-oxo-propyl)amino]propanoate CAS Name: 3-[2-(1-aziridinyl)ethyl-(3-methoxy-3-oxopropyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(aziridin-1-yl)ethyl-(3-methoxy-3-oxopropyl)amino]propanoate Traditional Name: 3-[2-ethyleniminoethyl-(3-keto-3-methoxy-propyl)amino]propionic acid methyl ester Formula: C12H22N2O4 MolecularWeight: 258.31408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(CCC(=O)OC)CCN1CC1

Isomeric SMILES

COC(=O)CCN(CCC(=O)OC)CCN1CC1

InChI

InChI=1S/C12H22N2O4/c1-17-11(15)3-5-13(6-4-12(16)18-2)7-8-14-9-10-14/h3-10H2,1-2H3