2-dimethylaminoethyl 2-phenyl-2-(thian-4-yl)ethaneperoxoate hydrochloride

Systemtic Name: 2-dimethylaminoethyl 2-phenyl-2-(thian-4-yl)ethaneperoxoate hydrochloride Openeye Name: 2-dimethylaminoethyl 2-phenyl-2-tetrahydrothiopyran-4-yl-peroxyacetate hydrochloride CAS Name: 2-phenyl-2-(4-thianyl)ethaneperoxoic acid 2-dimethylaminoethyl ester hydrochloride IUPAC Name: 2-dimethylaminoethyl 2-phenyl-2-(thian-4-yl)ethaneperoxoate hydrochloride Traditional Name: 2-phenyl-2-tetrahydrothiopyran-4-yl-peracetic acid 2-dimethylaminoethyl ester hydrochloride Formula: C17H26ClNO3S MolecularWeight: 359.91124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOOC(=O)C(C1CCSCC1)C2=CC=CC=C2.Cl

Isomeric SMILES

CN(C)CCOOC(=O)C(C1CCSCC1)C2=CC=CC=C2.Cl

InChI

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