2-[(3,4-dimethyl-3-oxidanyl-nonyl)amino]nonanedioic acid

Systemtic Name: 2-[(3,4-dimethyl-3-oxidanyl-nonyl)amino]nonanedioic acid Openeye Name: 2-[(3-hydroxy-3,4-dimethyl-nonyl)amino]nonanedioic acid CAS Name: 2-[(3-hydroxy-3,4-dimethylnonyl)amino]nonanedioic acid IUPAC Name: 2-[(3-hydroxy-3,4-dimethylnonyl)amino]nonanedioic acid Traditional Name: 2-[(3-hydroxy-3,4-dimethyl-nonyl)amino]azelaic acid Formula: C20H39NO5 MolecularWeight: 373.52736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(C)(CCNC(CCCCCCC(=O)O)C(=O)O)O

Isomeric SMILES

CCCCCC(C)C(C)(CCNC(CCCCCCC(=O)O)C(=O)O)O

InChI

InChI=1S/C20H39NO5/c1-4-5-8-11-16(2)20(3,26)14-15-21-17(19(24)25)12-9-6-7-10-13-18(22)23/h16-17,21,26H,4-15H2,1-3H3,(H,22,23)(H,24,25)