5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid

Systemtic Name: 5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid Openeye Name: 5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid CAS Name: 5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid IUPAC Name: 5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid Traditional Name: 5-decyl-2-(1,4,7,10,13-pentaoxacyclohexadec-15-ylmethoxy)benzoic acid Formula: C29H48O8 MolecularWeight: 524.68662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)OCC2COCCOCCOCCOCCOC2)C(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)OCC2COCCOCCOCCOCCOC2)C(=O)O

InChI

InChI=1S/C29H48O8/c1-2-3-4-5-6-7-8-9-10-25-11-12-28(27(21-25)29(30)31)37-24-26-22-35-19-17-33-15-13-32-14-16-34-18-20-36-23-26/h11-12,21,26H,2-10,13-20,22-24H2,1H3,(H,30,31)