phenyl 2-[4-(4-octylphenyl)phenyl]ethanoate

Systemtic Name: phenyl 2-[4-(4-octylphenyl)phenyl]ethanoate Openeye Name: phenyl 2-[4-(4-octylphenyl)phenyl]acetate CAS Name: 2-[4-(4-octylphenyl)phenyl]acetic acid phenyl ester IUPAC Name: phenyl 2-[4-(4-octylphenyl)phenyl]acetate Traditional Name: 2-[4-(4-octylphenyl)phenyl]acetic acid phenyl ester Formula: C28H32O2 MolecularWeight: 400.55248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C28H32O2/c1-2-3-4-5-6-8-11-23-14-18-25(19-15-23)26-20-16-24(17-21-26)22-28(29)30-27-12-9-7-10-13-27/h7,9-10,12-21H,2-6,8,11,22H2,1H3