[(3-oxidanylthiolan-3-yl)-phenyl-methyl] 3-(diethylamino)propanoate hydrochloride

Systemtic Name: [(3-oxidanylthiolan-3-yl)-phenyl-methyl] 3-(diethylamino)propanoate hydrochloride Openeye Name: [(3-hydroxytetrahydrothiophen-3-yl)-phenyl-methyl] 3-(diethylamino)propanoate hydrochloride CAS Name: 3-(diethylamino)propanoic acid [(3-hydroxy-3-thiolanyl)-phenylmethyl] ester hydrochloride IUPAC Name: [(3-hydroxythiolan-3-yl)-phenylmethyl] 3-(diethylamino)propanoate hydrochloride Traditional Name: 3-(diethylamino)propionic acid [(3-hydroxytetrahydrothiophen-3-yl)-phenyl-methyl] ester hydrochloride Formula: C18H28ClNO3S MolecularWeight: 373.93782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)OC(C1=CC=CC=C1)C2(CCSC2)O.Cl

Isomeric SMILES

CCN(CC)CCC(=O)OC(C1=CC=CC=C1)C2(CCSC2)O.Cl

InChI

InChI=1S/C18H27NO3S.ClH/c1-3-19(4-2)12-10-16(20)22-17(15-8-6-5-7-9-15)18(21)11-13-23-14-18;/h5-9,17,21H,3-4,10-14H2,1-2H3;1H