[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(5-chloranyl-2-methoxy-phenyl)ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(5-chloranyl-2-methoxy-phenyl)ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(5-chloro-2-methoxy-phenyl)acetate CAS Name: 2-(5-chloro-2-methoxyphenyl)acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(5-chloro-2-methoxyphenyl)acetate Traditional Name: 2-(5-chloro-2-methoxy-phenyl)acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H15ClN2O4 MolecularWeight: 310.7329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CC(=O)OCC(=O)NCCC#N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H15ClN2O4/c1-20-12-4-3-11(15)7-10(12)8-14(19)21-9-13(18)17-6-2-5-16/h3-4,7H,2,6,8-9H2,1H3,(H,17,18)