[4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]pyrrol-2-yl]phenyl] 3-phenylpropaneperoxoate

Systemtic Name: [4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]pyrrol-2-yl]phenyl] 3-phenylpropaneperoxoate Openeye Name: [4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]pyrrol-2-yl]phenyl] 3-phenylpropaneperoxoate CAS Name: 3-phenylpropaneperoxoic acid [4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]-2-pyrrolyl]phenyl] ester IUPAC Name: [4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]pyrrol-2-yl]phenyl] 3-phenylpropaneperoxoate Traditional Name: 3-phenylperoxypropionic acid [4-[5-methyl-1-[4-[(4-propylcyclohexyl)methoxy]phenyl]pyrrol-2-yl]phenyl] ester Formula: C36H41NO4 MolecularWeight: 551.71504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)COC2=CC=C(C=C2)N3C(=CC=C3C4=CC=C(C=C4)OOC(=O)CCC5=CC=CC=C5)C

Isomeric SMILES

CCCC1CCC(CC1)COC2=CC=C(C=C2)N3C(=CC=C3C4=CC=C(C=C4)OOC(=O)CCC5=CC=CC=C5)C

InChI

InChI=1S/C36H41NO4/c1-3-7-28-11-13-30(14-12-28)26-39-33-22-18-32(19-23-33)37-27(2)10-24-35(37)31-16-20-34(21-17-31)40-41-36(38)25-15-29-8-5-4-6-9-29/h4-6,8-10,16-24,28,30H,3,7,11-15,25-26H2,1-2H3