[4-(4-heptanoylphenyl)phenyl] ethanoate

Systemtic Name: [4-(4-heptanoylphenyl)phenyl] ethanoate Openeye Name: [4-(4-heptanoylphenyl)phenyl] acetate CAS Name: acetic acid [4-[4-(1-oxoheptyl)phenyl]phenyl] ester IUPAC Name: [4-(4-heptanoylphenyl)phenyl] acetate Traditional Name: acetic acid [4-(4-enanthylphenyl)phenyl] ester Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C

Isomeric SMILES

CCCCCCC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C

InChI

InChI=1S/C21H24O3/c1-3-4-5-6-7-21(23)19-10-8-17(9-11-19)18-12-14-20(15-13-18)24-16(2)22/h8-15H,3-7H2,1-2H3