[4-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3,4-bis(chloranyl)benzoate

Systemtic Name: [4-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3,4-bis(chloranyl)benzoate Openeye Name: [4-[(E)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3,4-dichlorobenzoate CAS Name: 3,4-dichlorobenzoic acid [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-2-methoxyphenyl] 3,4-dichlorobenzoate Traditional Name: 3,4-dichlorobenzoic acid [4-[(E)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C20H15Cl2NO5 MolecularWeight: 420.2428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)Cl)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)Cl)Cl)OC)/C#N

InChI

InChI=1S/C20H15Cl2NO5/c1-3-27-19(24)14(11-23)8-12-4-7-17(18(9-12)26-2)28-20(25)13-5-6-15(21)16(22)10-13/h4-10H,3H2,1-2H3/b14-8+