2-[4-(2-methylbutoxy)phenyl]-4-octoxy-benzoic acid

Systemtic Name: 2-[4-(2-methylbutoxy)phenyl]-4-octoxy-benzoic acid Openeye Name: 2-[4-(2-methylbutoxy)phenyl]-4-octoxy-benzoic acid CAS Name: 2-[4-(2-methylbutoxy)phenyl]-4-octoxybenzoic acid IUPAC Name: 2-[4-(2-methylbutoxy)phenyl]-4-octoxybenzoic acid Traditional Name: 2-[4-(2-methylbutoxy)phenyl]-4-octoxy-benzoic acid Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)OCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)OCC(C)CC

InChI

InChI=1S/C26H36O4/c1-4-6-7-8-9-10-17-29-23-15-16-24(26(27)28)25(18-23)21-11-13-22(14-12-21)30-19-20(3)5-2/h11-16,18,20H,4-10,17,19H2,1-3H3,(H,27,28)