S-(piperidin-1-ylmethyl) benzenecarbothioate hydrochloride

Systemtic Name: S-(piperidin-1-ylmethyl) benzenecarbothioate hydrochloride Openeye Name: S-(1-piperidylmethyl) benzenecarbothioate hydrochloride CAS Name: benzenecarbothioic acid S-(1-piperidinylmethyl) ester hydrochloride IUPAC Name: S-(piperidin-1-ylmethyl) benzenecarbothioate hydrochloride Traditional Name: thiobenzoic acid S-(piperidinomethyl) ester hydrochloride Formula: C13H18ClNOS MolecularWeight: 271.80612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CSC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

C1CCN(CC1)CSC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C13H17NOS.ClH/c15-13(12-7-3-1-4-8-12)16-11-14-9-5-2-6-10-14;/h1,3-4,7-8H,2,5-6,9-11H2;1H