4-(4-ethanoyl-12,12-dimethyl-8-oxidanyl-tridecyl)benzoic acid

Systemtic Name: 4-(4-ethanoyl-12,12-dimethyl-8-oxidanyl-tridecyl)benzoic acid Openeye Name: 4-(4-acetyl-8-hydroxy-12,12-dimethyl-tridecyl)benzoic acid CAS Name: 4-(4-acetyl-8-hydroxy-12,12-dimethyltridecyl)benzoic acid IUPAC Name: 4-(4-acetyl-8-hydroxy-12,12-dimethyltridecyl)benzoic acid Traditional Name: 4-(4-acetyl-8-hydroxy-12,12-dimethyl-tridecyl)benzoic acid Formula: C24H38O4 MolecularWeight: 390.55612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H38O4/c1-18(25)20(10-6-11-22(26)12-7-17-24(2,3)4)9-5-8-19-13-15-21(16-14-19)23(27)28/h13-16,20,22,26H,5-12,17H2,1-4H3,(H,27,28)