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

Systemtic Name: [4-(5-methyl-1-undecyl-pyrrol-2-yl)phenyl] 3-phenylpropaneperoxoate Openeye Name: [4-(5-methyl-1-undecyl-pyrrol-2-yl)phenyl] 3-phenylpropaneperoxoate CAS Name: 3-phenylpropaneperoxoic acid [4-(5-methyl-1-undecyl-2-pyrrolyl)phenyl] ester IUPAC Name: [4-(5-methyl-1-undecylpyrrol-2-yl)phenyl] 3-phenylpropaneperoxoate Traditional Name: 3-phenylperoxypropionic acid [4-(5-methyl-1-undecyl-pyrrol-2-yl)phenyl] ester Formula: C31H41NO3 MolecularWeight: 475.66214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(=CC=C1C2=CC=C(C=C2)OOC(=O)CCC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCCCCCN1C(=CC=C1C2=CC=C(C=C2)OOC(=O)CCC3=CC=CC=C3)C

InChI

InChI=1S/C31H41NO3/c1-3-4-5-6-7-8-9-10-14-25-32-26(2)17-23-30(32)28-19-21-29(22-20-28)34-35-31(33)24-18-27-15-12-11-13-16-27/h11-13,15-17,19-23H,3-10,14,18,24-25H2,1-2H3