[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[4-(phenylcarbonyl)phenoxy]ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[4-(phenylcarbonyl)phenoxy]ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(4-benzoylphenoxy)acetate CAS Name: 2-(4-benzoylphenoxy)acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(4-benzoylphenoxy)acetate Traditional Name: 2-(4-benzoylphenoxy)acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C20H18N2O5 MolecularWeight: 366.36732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C20H18N2O5/c21-11-4-12-22-18(23)13-27-19(24)14-26-17-9-7-16(8-10-17)20(25)15-5-2-1-3-6-15/h1-3,5-10H,4,12-14H2,(H,22,23)