4-(2-carboxyethyl)-5-oxidanylidene-4,6-dipentyl-nonanedioic acid

Systemtic Name: 4-(2-carboxyethyl)-5-oxidanylidene-4,6-dipentyl-nonanedioic acid Openeye Name: 4-(2-carboxyethyl)-5-oxo-4,6-dipentyl-nonanedioic acid CAS Name: 4-(2-carboxyethyl)-5-oxo-4,6-dipentylnonanedioic acid IUPAC Name: 4-(2-carboxyethyl)-5-oxo-4,6-dipentylnonanedioic acid Traditional Name: 4,6-diamyl-4-(2-carboxyethyl)-5-keto-azelaic acid Formula: C22H38O7 MolecularWeight: 414.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC(=O)O)C(=O)C(CCCCC)(CCC(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCC(CCC(=O)O)C(=O)C(CCCCC)(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C22H38O7/c1-3-5-7-9-17(10-11-18(23)24)21(29)22(14-8-6-4-2,15-12-19(25)26)16-13-20(27)28/h17H,3-16H2,1-2H3,(H,23,24)(H,25,26)(H,27,28)