3-octan-4-yloxy-4-phenyl-benzoic acid

Systemtic Name: 3-octan-4-yloxy-4-phenyl-benzoic acid Openeye Name: 4-phenyl-3-(1-propylpentoxy)benzoic acid CAS Name: 3-octan-4-yloxy-4-phenylbenzoic acid IUPAC Name: 3-octan-4-yloxy-4-phenylbenzoic acid Traditional Name: 4-phenyl-3-(1-propylpentoxy)benzoic acid Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)OC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(CCC)OC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-3-5-12-18(9-4-2)24-20-15-17(21(22)23)13-14-19(20)16-10-7-6-8-11-16/h6-8,10-11,13-15,18H,3-5,9,12H2,1-2H3,(H,22,23)