2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)ethanone Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25NO3S/c24-22(16-27-19-6-7-20-21(15-19)26-13-12-25-20)23-10-8-18(9-11-23)14-17-4-2-1-3-5-17/h1-7,15,18H,8-14,16H2