4-hexyl-2-(phenylmethyl)benzoic acid

Systemtic Name: 4-hexyl-2-(phenylmethyl)benzoic acid Openeye Name: 2-benzyl-4-hexyl-benzoic acid CAS Name: 4-hexyl-2-(phenylmethyl)benzoic acid IUPAC Name: 2-benzyl-4-hexylbenzoic acid Traditional Name: 2-benzyl-4-hexyl-benzoic acid Formula: C20H24O2 MolecularWeight: 296.40336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)C(=O)O)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)C(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C20H24O2/c1-2-3-4-6-11-17-12-13-19(20(21)22)18(15-17)14-16-9-7-5-8-10-16/h5,7-10,12-13,15H,2-4,6,11,14H2,1H3,(H,21,22)