5-dodecyl-2-oxidanyl-3-(2-phenylpropan-2-yl)benzoic acid

Systemtic Name: 5-dodecyl-2-oxidanyl-3-(2-phenylpropan-2-yl)benzoic acid Openeye Name: 5-dodecyl-2-hydroxy-3-(1-methyl-1-phenyl-ethyl)benzoic acid CAS Name: 5-dodecyl-2-hydroxy-3-(2-phenylpropan-2-yl)benzoic acid IUPAC Name: 5-dodecyl-2-hydroxy-3-(2-phenylpropan-2-yl)benzoic acid Traditional Name: 3-cumyl-2-hydroxy-5-lauryl-benzoic acid Formula: C28H40O3 MolecularWeight: 424.6154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C28H40O3/c1-4-5-6-7-8-9-10-11-12-14-17-22-20-24(27(30)31)26(29)25(21-22)28(2,3)23-18-15-13-16-19-23/h13,15-16,18-21,29H,4-12,14,17H2,1-3H3,(H,30,31)