4-(4-ethanoyl-12-methyl-8-oxidanyl-tridecyl)benzoic acid

Systemtic Name: 4-(4-ethanoyl-12-methyl-8-oxidanyl-tridecyl)benzoic acid Openeye Name: 4-(4-acetyl-8-hydroxy-12-methyl-tridecyl)benzoic acid CAS Name: 4-(4-acetyl-8-hydroxy-12-methyltridecyl)benzoic acid IUPAC Name: 4-(4-acetyl-8-hydroxy-12-methyltridecyl)benzoic acid Traditional Name: 4-(4-acetyl-8-hydroxy-12-methyl-tridecyl)benzoic acid Formula: C23H36O4 MolecularWeight: 376.52954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(=O)C)O

Isomeric SMILES

CC(C)CCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(=O)C)O

InChI

InChI=1S/C23H36O4/c1-17(2)7-4-11-22(25)12-6-10-20(18(3)24)9-5-8-19-13-15-21(16-14-19)23(26)27/h13-17,20,22,25H,4-12H2,1-3H3,(H,26,27)