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

Systemtic Name: 8-[[4-(2-chloranylphenoxy)-3-oxidanyl-butyl]amino]-9-(oxan-2-yloxy)nonanoic acid Openeye Name: 8-[[4-(2-chlorophenoxy)-3-hydroxy-butyl]amino]-9-tetrahydropyran-2-yloxy-nonanoic acid CAS Name: 8-[[4-(2-chlorophenoxy)-3-hydroxybutyl]amino]-9-(2-oxanyloxy)nonanoic acid IUPAC Name: 8-[[4-(2-chlorophenoxy)-3-hydroxybutyl]amino]-9-(oxan-2-yloxy)nonanoic acid Traditional Name: 8-[[4-(2-chlorophenoxy)-3-hydroxy-butyl]amino]-9-tetrahydropyran-2-yloxy-pelargonic acid Formula: C24H38ClNO6 MolecularWeight: 472.01462

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC(CCCCCCC(=O)O)NCCC(COC2=CC=CC=C2Cl)O

Isomeric SMILES

C1CCOC(C1)OCC(CCCCCCC(=O)O)NCCC(COC2=CC=CC=C2Cl)O

InChI

InChI=1S/C24H38ClNO6/c25-21-10-5-6-11-22(21)31-18-20(27)14-15-26-19(9-3-1-2-4-12-23(28)29)17-32-24-13-7-8-16-30-24/h5-6,10-11,19-20,24,26-27H,1-4,7-9,12-18H2,(H,28,29)