4-[(2-methylpropan-2-yl)oxycarbonyl]-2-[2-(4-propylphenyl)ethyl]nonanedioic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-[2-(4-propylphenyl)ethyl]nonanedioic acid Openeye Name: 4-tert-butoxycarbonyl-2-[2-(4-propylphenyl)ethyl]nonanedioic acid CAS Name: 4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-[2-(4-propylphenyl)ethyl]nonanedioic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-[2-(4-propylphenyl)ethyl]nonanedioic acid Traditional Name: 4-tert-butoxycarbonyl-2-[2-(4-propylphenyl)ethyl]azelaic acid Formula: C25H38O6 MolecularWeight: 434.56562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CCC(CC(CCCCC(=O)O)C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)CCC(CC(CCCCC(=O)O)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C25H38O6/c1-5-8-18-11-13-19(14-12-18)15-16-20(23(28)29)17-21(9-6-7-10-22(26)27)24(30)31-25(2,3)4/h11-14,20-21H,5-10,15-17H2,1-4H3,(H,26,27)(H,28,29)