methyl 4-[(E)-3-(2-chloranyl-4-cyano-6-ethoxy-phenoxy)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(2-chloranyl-4-cyano-6-ethoxy-phenoxy)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(2-chloro-4-cyano-6-ethoxy-phenoxy)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(2-chloro-4-cyano-6-ethoxyphenoxy)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(2-chloro-4-cyano-6-ethoxyphenoxy)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(2-chloro-4-cyano-6-ethoxy-phenoxy)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C20H16ClNO5 MolecularWeight: 385.79774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Cl)OC(=O)C=CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Cl)OC(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H16ClNO5/c1-3-26-17-11-14(12-22)10-16(21)19(17)27-18(23)9-6-13-4-7-15(8-5-13)20(24)25-2/h4-11H,3H2,1-2H3/b9-6+