8-[[4-(2,4-dimethylphenoxy)-3-oxidanyl-butyl]amino]-9-(oxan-2-yloxy)nonanoic acid

Systemtic Name: 8-[[4-(2,4-dimethylphenoxy)-3-oxidanyl-butyl]amino]-9-(oxan-2-yloxy)nonanoic acid Openeye Name: 8-[[4-(2,4-dimethylphenoxy)-3-hydroxy-butyl]amino]-9-tetrahydropyran-2-yloxy-nonanoic acid CAS Name: 8-[[4-(2,4-dimethylphenoxy)-3-hydroxybutyl]amino]-9-(2-oxanyloxy)nonanoic acid IUPAC Name: 8-[[4-(2,4-dimethylphenoxy)-3-hydroxybutyl]amino]-9-(oxan-2-yloxy)nonanoic acid Traditional Name: 8-[[4-(2,4-dimethylphenoxy)-3-hydroxy-butyl]amino]-9-tetrahydropyran-2-yloxy-pelargonic acid Formula: C26H43NO6 MolecularWeight: 465.62272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(CCNC(CCCCCCC(=O)O)COC2CCCCO2)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(CCNC(CCCCCCC(=O)O)COC2CCCCO2)O)C

InChI

InChI=1S/C26H43NO6/c1-20-12-13-24(21(2)17-20)32-19-23(28)14-15-27-22(9-5-3-4-6-10-25(29)30)18-33-26-11-7-8-16-31-26/h12-13,17,22-23,26-28H,3-11,14-16,18-19H2,1-2H3,(H,29,30)