[4-[(E)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: [4-[(E)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate Openeye Name: [4-[(E)-3-(4-chlorophenyl)-3-oxo-prop-1-enyl]phenyl] 5-ethoxy-2-methyl-benzofuran-3-carboxylate CAS Name: 5-ethoxy-2-methyl-3-benzofurancarboxylic acid [4-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-ethoxy-2-methyl-benzofuran-3-carboxylic acid [4-[(E)-3-(4-chlorophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C27H21ClO5 MolecularWeight: 460.90564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC=C(C=C3)C=CC(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC=C(C=C3)/C=C/C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H21ClO5/c1-3-31-22-13-15-25-23(16-22)26(17(2)32-25)27(30)33-21-11-4-18(5-12-21)6-14-24(29)19-7-9-20(28)10-8-19/h4-16H,3H2,1-2H3/b14-6+