9-(oxan-2-yloxy)-8-[(3-oxidanyl-5-thiophen-2-yl-pentyl)amino]nonanoic acid

Systemtic Name: 9-(oxan-2-yloxy)-8-[(3-oxidanyl-5-thiophen-2-yl-pentyl)amino]nonanoic acid Openeye Name: 8-[[3-hydroxy-5-(2-thienyl)pentyl]amino]-9-tetrahydropyran-2-yloxy-nonanoic acid CAS Name: 8-[(3-hydroxy-5-thiophen-2-ylpentyl)amino]-9-(2-oxanyloxy)nonanoic acid IUPAC Name: 8-[(3-hydroxy-5-thiophen-2-ylpentyl)amino]-9-(oxan-2-yloxy)nonanoic acid Traditional Name: 8-[[3-hydroxy-5-(2-thienyl)pentyl]amino]-9-tetrahydropyran-2-yloxy-pelargonic acid Formula: C23H39NO5S MolecularWeight: 441.62446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC(CCCCCCC(=O)O)NCCC(CCC2=CC=CS2)O

Isomeric SMILES

C1CCOC(C1)OCC(CCCCCCC(=O)O)NCCC(CCC2=CC=CS2)O

InChI

InChI=1S/C23H39NO5S/c25-20(12-13-21-9-7-17-30-21)14-15-24-19(8-3-1-2-4-10-22(26)27)18-29-23-11-5-6-16-28-23/h7,9,17,19-20,23-25H,1-6,8,10-16,18H2,(H,26,27)