1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)heptan-4-one

Systemtic Name: 1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)heptan-4-one Openeye Name: 1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)heptan-4-one CAS Name: 1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)-4-heptanone IUPAC Name: 1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)heptan-4-one Traditional Name: 1,7-bis(1,3-benzodioxol-5-yl)-3,5-bis(methylsulfinyl)heptan-4-one Formula: C23H26O7S2 MolecularWeight: 478.57834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C(CCC1=CC2=C(C=C1)OCO2)C(=O)C(CCC3=CC4=C(C=C3)OCO4)S(=O)C

Isomeric SMILES

CS(=O)C(CCC1=CC2=C(C=C1)OCO2)C(=O)C(CCC3=CC4=C(C=C3)OCO4)S(=O)C

InChI

InChI=1S/C23H26O7S2/c1-31(25)21(9-5-15-3-7-17-19(11-15)29-13-27-17)23(24)22(32(2)26)10-6-16-4-8-18-20(12-16)30-14-28-18/h3-4,7-8,11-12,21-22H,5-6,9-10,13-14H2,1-2H3