[(E)-octadec-9-enyl] 5-(dimethylamino)pentaneperoxoate hydrochloride

Systemtic Name: [(E)-octadec-9-enyl] 5-(dimethylamino)pentaneperoxoate hydrochloride Openeye Name: [(E)-octadec-9-enyl] 5-(dimethylamino)pentaneperoxoate hydrochloride CAS Name: 5-(dimethylamino)pentaneperoxoic acid [(E)-octadec-9-enyl] ester hydrochloride IUPAC Name: [(E)-octadec-9-enyl] 5-(dimethylamino)pentaneperoxoate hydrochloride Traditional Name: 5-(dimethylamino)peroxyvaleric acid [(E)-octadec-9-enyl] ester hydrochloride Formula: C25H50ClNO3 MolecularWeight: 448.1224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOOC(=O)CCCCN(C)C.Cl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOOC(=O)CCCCN(C)C.Cl

InChI

InChI=1S/C25H49NO3.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-28-29-25(27)22-19-20-23-26(2)3;/h11-12H,4-10,13-24H2,1-3H3;1H/b12-11+;