[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2,6-bis(chloranyl)phenyl]ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2,6-bis(chloranyl)phenyl]ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(2,6-dichlorophenyl)acetate CAS Name: 2-(2,6-dichlorophenyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(2,6-dichlorophenyl)acetate Traditional Name: 2-(2,6-dichlorophenyl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H12Cl2N2O3 MolecularWeight: 327.16268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CC1=C(C=CC=C1Cl)Cl)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CC1=C(C=CC=C1Cl)Cl)/N

InChI

InChI=1S/C14H12Cl2N2O3/c1-8(18)10(6-17)13(19)7-21-14(20)5-9-11(15)3-2-4-12(9)16/h2-4H,5,7,18H2,1H3/b10-8+