2-(phenylmethyl)hexadecanoic acid

Systemtic Name: 2-(phenylmethyl)hexadecanoic acid Openeye Name: 2-benzylhexadecanoic acid CAS Name: 2-(phenylmethyl)hexadecanoic acid IUPAC Name: 2-benzylhexadecanoic acid Traditional Name: 2-benzylpalmitic acid Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-19-22(23(24)25)20-21-17-14-13-15-18-21/h13-15,17-18,22H,2-12,16,19-20H2,1H3,(H,24,25)