7-[2,3-dimethoxy-6-[[4-(4-oxidanyl-4-oxidanylidene-butyl)piperazin-1-yl]methyl]phenoxy]heptanoic acid

Systemtic Name: 7-[2,3-dimethoxy-6-[[4-(4-oxidanyl-4-oxidanylidene-butyl)piperazin-1-yl]methyl]phenoxy]heptanoic acid Openeye Name: 7-[6-[[4-(4-hydroxy-4-oxo-butyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenoxy]heptanoic acid CAS Name: 7-[6-[[4-(4-hydroxy-4-oxobutyl)-1-piperazinyl]methyl]-2,3-dimethoxyphenoxy]heptanoic acid IUPAC Name: 7-[6-[[4-(4-hydroxy-4-oxobutyl)piperazin-1-yl]methyl]-2,3-dimethoxyphenoxy]heptanoic acid Traditional Name: 7-[6-[[4-(4-hydroxy-4-keto-butyl)piperazino]methyl]-2,3-dimethoxy-phenoxy]enanthic acid Formula: C24H38N2O7 MolecularWeight: 466.56772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CCCC(=O)O)OCCCCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CCCC(=O)O)OCCCCCCC(=O)O)OC

InChI

InChI=1S/C24H38N2O7/c1-31-20-11-10-19(18-26-15-13-25(14-16-26)12-7-9-22(29)30)23(24(20)32-2)33-17-6-4-3-5-8-21(27)28/h10-11H,3-9,12-18H2,1-2H3,(H,27,28)(H,29,30)