1-(1,3-benzodioxol-5-yl)-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-(phenylmethylsulfanyl)ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-benzylsulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-(phenylmethylthio)ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-benzylsulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-(benzylthio)ethanone Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C16H14O3S/c17-14(10-20-9-12-4-2-1-3-5-12)13-6-7-15-16(8-13)19-11-18-15/h1-8H,9-11H2