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

Systemtic Name: 9-(oxan-2-yloxy)-8-[[3-oxidanyl-4-(4-propylphenoxy)butyl]amino]nonanoic acid Openeye Name: 8-[[3-hydroxy-4-(4-propylphenoxy)butyl]amino]-9-tetrahydropyran-2-yloxy-nonanoic acid CAS Name: 8-[[3-hydroxy-4-(4-propylphenoxy)butyl]amino]-9-(2-oxanyloxy)nonanoic acid IUPAC Name: 8-[[3-hydroxy-4-(4-propylphenoxy)butyl]amino]-9-(oxan-2-yloxy)nonanoic acid Traditional Name: 8-[[3-hydroxy-4-(4-propylphenoxy)butyl]amino]-9-tetrahydropyran-2-yloxy-pelargonic acid Formula: C27H45NO6 MolecularWeight: 479.6493

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(CCNC(CCCCCCC(=O)O)COC2CCCCO2)O

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(CCNC(CCCCCCC(=O)O)COC2CCCCO2)O

InChI

InChI=1S/C27H45NO6/c1-2-9-22-13-15-25(16-14-22)33-21-24(29)17-18-28-23(10-5-3-4-6-11-26(30)31)20-34-27-12-7-8-19-32-27/h13-16,23-24,27-29H,2-12,17-21H2,1H3,(H,30,31)