octadecyl 5-[methyl-(phenylmethyl)amino]pentaneperoxoate hydrochloride

Systemtic Name: octadecyl 5-[methyl-(phenylmethyl)amino]pentaneperoxoate hydrochloride Openeye Name: octadecyl 5-[benzyl(methyl)amino]pentaneperoxoate hydrochloride CAS Name: 5-[methyl-(phenylmethyl)amino]pentaneperoxoic acid octadecyl ester hydrochloride IUPAC Name: octadecyl 5-[benzyl(methyl)amino]pentaneperoxoate hydrochloride Traditional Name: 5-[benzyl(methyl)amino]peroxyvaleric acid stearyl ester hydrochloride Formula: C31H56ClNO3 MolecularWeight: 526.23424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOOC(=O)CCCCN(C)CC1=CC=CC=C1.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOOC(=O)CCCCN(C)CC1=CC=CC=C1.Cl

InChI

InChI=1S/C31H55NO3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-28-34-35-31(33)26-21-22-27-32(2)29-30-24-19-18-20-25-30;/h18-20,24-25H,3-17,21-23,26-29H2,1-2H3;1H