[4-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate

Systemtic Name: [4-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Openeye Name: [4-[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]phenyl] 5-benzyloxy-2-methyl-benzofuran-3-carboxylate CAS Name: 2-methyl-5-phenylmethoxy-3-benzofurancarboxylic acid [4-[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Traditional Name: 5-benzoxy-2-methyl-benzofuran-3-carboxylic acid [4-[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]phenyl] ester Formula: C32H22ClFO5 MolecularWeight: 540.965483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(=O)C=CC5=C(C=CC=C5Cl)F

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(=O)/C=C/C5=C(C=CC=C5Cl)F

InChI

InChI=1S/C32H22ClFO5/c1-20-31(26-18-24(14-17-30(26)38-20)37-19-21-6-3-2-4-7-21)32(36)39-23-12-10-22(11-13-23)29(35)16-15-25-27(33)8-5-9-28(25)34/h2-18H,19H2,1H3/b16-15+