[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-chloranylphenoxy)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-chloranylphenoxy)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(4-chlorophenoxy)acetate CAS Name: 2-(4-chlorophenoxy)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(4-chlorophenoxy)acetate Traditional Name: 2-(4-chlorophenoxy)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H13ClN2O4 MolecularWeight: 308.71702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)COC1=CC=C(C=C1)Cl)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)COC1=CC=C(C=C1)Cl)/N

InChI

InChI=1S/C14H13ClN2O4/c1-9(17)12(6-16)13(18)7-21-14(19)8-20-11-4-2-10(15)3-5-11/h2-5H,7-8,17H2,1H3/b12-9+