3-(dimethylamino)propyl 2-phenyl-2-(thiolan-3-yl)ethaneperoxoate hydrochloride

Systemtic Name: 3-(dimethylamino)propyl 2-phenyl-2-(thiolan-3-yl)ethaneperoxoate hydrochloride Openeye Name: 3-(dimethylamino)propyl 2-phenyl-2-tetrahydrothiophen-3-yl-peroxyacetate hydrochloride CAS Name: 2-phenyl-2-(3-thiolanyl)ethaneperoxoic acid 3-(dimethylamino)propyl ester hydrochloride IUPAC Name: 3-(dimethylamino)propyl 2-phenyl-2-(thiolan-3-yl)ethaneperoxoate hydrochloride Traditional Name: 2-phenyl-2-tetrahydrothiophen-3-yl-peracetic acid 3-(dimethylamino)propyl ester hydrochloride Formula: C17H26ClNO3S MolecularWeight: 359.91124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOOC(=O)C(C1CCSC1)C2=CC=CC=C2.Cl

Isomeric SMILES

CN(C)CCCOOC(=O)C(C1CCSC1)C2=CC=CC=C2.Cl

InChI

InChI=1S/C17H25NO3S.ClH/c1-18(2)10-6-11-20-21-17(19)16(15-9-12-22-13-15)14-7-4-3-5-8-14;/h3-5,7-8,15-16H,6,9-13H2,1-2H3;1H