1-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)sulfanyl-ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)sulfanyl-ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)sulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)sulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[(4-methoxyphenyl)thio]ethanone Formula: C16H14O4S MolecularWeight: 302.34496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H14O4S/c1-18-12-3-5-13(6-4-12)21-9-14(17)11-2-7-15-16(8-11)20-10-19-15/h2-8H,9-10H2,1H3