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

Systemtic Name: 2-diethylaminoethyl 2-phenyl-2-(thian-4-yl)ethaneperoxoate hydrochloride Openeye Name: 2-diethylaminoethyl 2-phenyl-2-tetrahydrothiopyran-4-yl-peroxyacetate hydrochloride CAS Name: 2-phenyl-2-(4-thianyl)ethaneperoxoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 2-phenyl-2-(thian-4-yl)ethaneperoxoate hydrochloride Traditional Name: 2-phenyl-2-tetrahydrothiopyran-4-yl-peracetic acid 2-diethylaminoethyl ester hydrochloride Formula: C19H30ClNO3S MolecularWeight: 387.9644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO3S.ClH/c1-3-20(4-2)12-13-22-23-19(21)18(16-8-6-5-7-9-16)17-10-14-24-15-11-17;/h5-9,17-18H,3-4,10-15H2,1-2H3;1H