[4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl] 2-methyl-3-phenyl-propaneperoxoate

Systemtic Name: [4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl] 2-methyl-3-phenyl-propaneperoxoate Openeye Name: [4-[4-(2-benzylbenzofuran-3-yl)phenyl]phenyl] 2-methyl-3-phenyl-propaneperoxoate CAS Name: 2-methyl-3-phenylpropaneperoxoic acid [4-[4-[2-(phenylmethyl)-3-benzofuranyl]phenyl]phenyl] ester IUPAC Name: [4-[4-(2-benzyl-1-benzofuran-3-yl)phenyl]phenyl] 2-methyl-3-phenylpropaneperoxoate Traditional Name: 2-methyl-3-phenyl-peroxypropionic acid [4-[4-(2-benzylbenzofuran-3-yl)phenyl]phenyl] ester Formula: C37H30O4 MolecularWeight: 538.6317

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C(=O)OOC2=CC=C(C=C2)C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

CC(CC1=CC=CC=C1)C(=O)OOC2=CC=C(C=C2)C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C37H30O4/c1-26(24-27-10-4-2-5-11-27)37(38)41-40-32-22-20-30(21-23-32)29-16-18-31(19-17-29)36-33-14-8-9-15-34(33)39-35(36)25-28-12-6-3-7-13-28/h2-23,26H,24-25H2,1H3