methyl 2-[(2-chloranylethanoylamino)methyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-[(2-chloranylethanoylamino)methyl]-3-oxidanylidene-butanoate Openeye Name: methyl 2-[[(2-chloroacetyl)amino]methyl]-3-oxo-butanoate CAS Name: 2-[[(2-chloro-1-oxoethyl)amino]methyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-[[(2-chloroacetyl)amino]methyl]-3-oxobutanoate Traditional Name: 2-[[(2-chloroacetyl)amino]methyl]-3-keto-butyric acid methyl ester Formula: C8H12ClNO4 MolecularWeight: 221.63818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CNC(=O)CCl)C(=O)OC

Isomeric SMILES

CC(=O)C(CNC(=O)CCl)C(=O)OC

InChI

InChI=1S/C8H12ClNO4/c1-5(11)6(8(13)14-2)4-10-7(12)3-9/h6H,3-4H2,1-2H3,(H,10,12)