4-[4-(1-dodecoxyethyl)phenyl]benzoic acid

Systemtic Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid Openeye Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid CAS Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid IUPAC Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid Traditional Name: 4-[4-(1-lauryloxyethyl)phenyl]benzoic acid Formula: C27H38O3 MolecularWeight: 410.58882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38O3/c1-3-4-5-6-7-8-9-10-11-12-21-30-22(2)23-13-15-24(16-14-23)25-17-19-26(20-18-25)27(28)29/h13-20,22H,3-12,21H2,1-2H3,(H,28,29)