5-heptylsulfanylindene-1,2,3-trione

Systemtic Name: 5-heptylsulfanylindene-1,2,3-trione Openeye Name: 5-heptylsulfanylindane-1,2,3-trione CAS Name: 5-(heptylthio)indene-1,2,3-trione IUPAC Name: 5-heptylsulfanylindene-1,2,3-trione Traditional Name: 5-(heptylthio)indane-1,2,3-trione Formula: C16H18O3S MolecularWeight: 290.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=CC2=C(C=C1)C(=O)C(=O)C2=O

Isomeric SMILES

CCCCCCCSC1=CC2=C(C=C1)C(=O)C(=O)C2=O

InChI

InChI=1S/C16H18O3S/c1-2-3-4-5-6-9-20-11-7-8-12-13(10-11)15(18)16(19)14(12)17/h7-8,10H,2-6,9H2,1H3