4-(4-hexadecylphenyl)benzoic acid

Systemtic Name: 4-(4-hexadecylphenyl)benzoic acid Openeye Name: 4-(4-hexadecylphenyl)benzoic acid CAS Name: 4-(4-hexadecylphenyl)benzoic acid IUPAC Name: 4-(4-hexadecylphenyl)benzoic acid Traditional Name: 4-(4-cetylphenyl)benzoic acid Formula: C29H42O2 MolecularWeight: 422.64258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C29H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25-17-19-26(20-18-25)27-21-23-28(24-22-27)29(30)31/h17-24H,2-16H2,1H3,(H,30,31)