[4-[2-[2-methyl-5-(2-naphthalen-1-ylethyl)pyrrol-1-yl]ethyl]phenyl] 3-phenylpropaneperoxoate

Systemtic Name: [4-[2-[2-methyl-5-(2-naphthalen-1-ylethyl)pyrrol-1-yl]ethyl]phenyl] 3-phenylpropaneperoxoate Openeye Name: [4-[2-[2-methyl-5-[2-(1-naphthyl)ethyl]pyrrol-1-yl]ethyl]phenyl] 3-phenylpropaneperoxoate CAS Name: 3-phenylpropaneperoxoic acid [4-[2-[2-methyl-5-[2-(1-naphthalenyl)ethyl]-1-pyrrolyl]ethyl]phenyl] ester IUPAC Name: [4-[2-[2-methyl-5-(2-naphthalen-1-ylethyl)pyrrol-1-yl]ethyl]phenyl] 3-phenylpropaneperoxoate Traditional Name: 3-phenylperoxypropionic acid [4-[2-[2-methyl-5-[2-(1-naphthyl)ethyl]pyrrol-1-yl]ethyl]phenyl] ester Formula: C34H33NO3 MolecularWeight: 503.63072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1CCC2=CC=C(C=C2)OOC(=O)CCC3=CC=CC=C3)CCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(N1CCC2=CC=C(C=C2)OOC(=O)CCC3=CC=CC=C3)CCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C34H33NO3/c1-26-14-19-31(20-18-30-12-7-11-29-10-5-6-13-33(29)30)35(26)25-24-28-15-21-32(22-16-28)37-38-34(36)23-17-27-8-3-2-4-9-27/h2-16,19,21-22H,17-18,20,23-25H2,1H3