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

Systemtic Name: [2-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Openeye Name: [2-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]phenyl] 5-benzyloxy-2-methyl-benzofuran-3-carboxylate CAS Name: 2-methyl-5-phenylmethoxy-3-benzofurancarboxylic acid [2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Traditional Name: 5-benzoxy-2-methyl-benzofuran-3-carboxylic acid [2-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C32H23BrO5 MolecularWeight: 567.42602

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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=CC=C4C=CC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

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

InChI

InChI=1S/C32H23BrO5/c1-21-31(27-19-26(16-18-30(27)37-21)36-20-22-7-3-2-4-8-22)32(35)38-29-10-6-5-9-24(29)13-17-28(34)23-11-14-25(33)15-12-23/h2-19H,20H2,1H3/b17-13+