[2-(5-pyrrol-1-ylpentoxy)phenyl] 2,2-dimethylhexaneperoxoate

Systemtic Name: [2-(5-pyrrol-1-ylpentoxy)phenyl] 2,2-dimethylhexaneperoxoate Openeye Name: [2-(5-pyrrol-1-ylpentoxy)phenyl] 2,2-dimethylhexaneperoxoate CAS Name: 2,2-dimethylhexaneperoxoic acid [2-[5-(1-pyrrolyl)pentoxy]phenyl] ester IUPAC Name: [2-(5-pyrrol-1-ylpentoxy)phenyl] 2,2-dimethylhexaneperoxoate Traditional Name: 2,2-dimethylhexaneperoxoic acid [2-(5-pyrrol-1-ylpentoxy)phenyl] ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(=O)OOC1=CC=CC=C1OCCCCCN2C=CC=C2

Isomeric SMILES

CCCCC(C)(C)C(=O)OOC1=CC=CC=C1OCCCCCN2C=CC=C2

InChI

InChI=1S/C23H33NO4/c1-4-5-15-23(2,3)22(25)28-27-21-14-8-7-13-20(21)26-19-12-6-9-16-24-17-10-11-18-24/h7-8,10-11,13-14,17-18H,4-6,9,12,15-16,19H2,1-3H3