3-(4-propanoyl-2,6-dipropyl-phenyl)-2-(4-propan-2-ylphenyl)propanoic acid

Systemtic Name: 3-(4-propanoyl-2,6-dipropyl-phenyl)-2-(4-propan-2-ylphenyl)propanoic acid Openeye Name: 2-(4-isopropylphenyl)-3-(4-propanoyl-2,6-dipropyl-phenyl)propanoic acid CAS Name: 3-[4-(1-oxopropyl)-2,6-dipropylphenyl]-2-(4-propan-2-ylphenyl)propanoic acid IUPAC Name: 3-(4-propanoyl-2,6-dipropylphenyl)-2-(4-propan-2-ylphenyl)propanoic acid Traditional Name: 2-p-cumenyl-3-(4-propionyl-2,6-dipropyl-phenyl)propionic acid Formula: C27H36O3 MolecularWeight: 408.57294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1CC(C2=CC=C(C=C2)C(C)C)C(=O)O)CCC)C(=O)CC

Isomeric SMILES

CCCC1=CC(=CC(=C1CC(C2=CC=C(C=C2)C(C)C)C(=O)O)CCC)C(=O)CC

InChI

InChI=1S/C27H36O3/c1-6-9-21-15-23(26(28)8-3)16-22(10-7-2)24(21)17-25(27(29)30)20-13-11-19(12-14-20)18(4)5/h11-16,18,25H,6-10,17H2,1-5H3,(H,29,30)