2-[2-(2-ethylhexyl)-4-phenyl-phenyl]carbonylbenzoic acid

Systemtic Name: 2-[2-(2-ethylhexyl)-4-phenyl-phenyl]carbonylbenzoic acid Openeye Name: 2-[2-(2-ethylhexyl)-4-phenyl-benzoyl]benzoic acid CAS Name: 2-[[2-(2-ethylhexyl)-4-phenylphenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-(2-ethylhexyl)-4-phenylbenzoyl]benzoic acid Traditional Name: 2-[2-(2-ethylhexyl)-4-phenyl-benzoyl]benzoic acid Formula: C28H30O3 MolecularWeight: 414.536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C=CC(=C1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCCC(CC)CC1=C(C=CC(=C1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C28H30O3/c1-3-5-11-20(4-2)18-23-19-22(21-12-7-6-8-13-21)16-17-24(23)27(29)25-14-9-10-15-26(25)28(30)31/h6-10,12-17,19-20H,3-5,11,18H2,1-2H3,(H,30,31)