4-(4-hexan-2-ylphenyl)benzoic acid

Systemtic Name: 4-(4-hexan-2-ylphenyl)benzoic acid Openeye Name: 4-[4-(1-methylpentyl)phenyl]benzoic acid CAS Name: 4-(4-hexan-2-ylphenyl)benzoic acid IUPAC Name: 4-(4-hexan-2-ylphenyl)benzoic acid Traditional Name: 4-[4-(1-methylpentyl)phenyl]benzoic acid Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O2/c1-3-4-5-14(2)15-6-8-16(9-7-15)17-10-12-18(13-11-17)19(20)21/h6-14H,3-5H2,1-2H3,(H,20,21)