[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 2-(2-chlorophenoxy)acetate CAS Name: 2-(2-chlorophenoxy)acetic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 2-(2-chlorophenoxy)acetate Traditional Name: 2-(2-chlorophenoxy)acetic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C16H16ClN3O4 MolecularWeight: 349.76894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC(=O)OCC(=O)N(CCC#N)CCC#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCC(=O)OCC(=O)N(CCC#N)CCC#N)Cl

InChI

InChI=1S/C16H16ClN3O4/c17-13-5-1-2-6-14(13)23-12-16(22)24-11-15(21)20(9-3-7-18)10-4-8-19/h1-2,5-6H,3-4,9-12H2