[4-(phenylcarbonyl)phenyl] 2-(3-heptoxyphenoxy)ethanoate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 2-(3-heptoxyphenoxy)ethanoate Openeye Name: (4-benzoylphenyl) 2-(3-heptoxyphenoxy)acetate CAS Name: 2-(3-heptoxyphenoxy)acetic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 2-(3-heptoxyphenoxy)acetate Traditional Name: 2-(3-heptoxyphenoxy)acetic acid (4-benzoylphenyl) ester Formula: C28H30O5 MolecularWeight: 446.5348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)OCC(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)OCC(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H30O5/c1-2-3-4-5-9-19-31-25-13-10-14-26(20-25)32-21-27(29)33-24-17-15-23(16-18-24)28(30)22-11-7-6-8-12-22/h6-8,10-18,20H,2-5,9,19,21H2,1H3