methyl 4-cyano-4-(3,4-dichlorophenyl)-6-oxidanylidene-hexanoate

Systemtic Name: methyl 4-cyano-4-(3,4-dichlorophenyl)-6-oxidanylidene-hexanoate Openeye Name: methyl 4-cyano-4-(3,4-dichlorophenyl)-6-oxo-hexanoate CAS Name: 4-cyano-4-(3,4-dichlorophenyl)-6-oxohexanoic acid methyl ester IUPAC Name: methyl 4-cyano-4-(3,4-dichlorophenyl)-6-oxohexanoate Traditional Name: 4-cyano-4-(3,4-dichlorophenyl)-6-keto-hexanoic acid methyl ester Formula: C14H13Cl2NO3 MolecularWeight: 314.16392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13Cl2NO3/c1-20-13(19)4-5-14(9-17,6-7-18)10-2-3-11(15)12(16)8-10/h2-3,7-8H,4-6H2,1H3