1-[4-(4-hexoxyphenyl)phenyl]ethyl 3-methylpentanoate

Systemtic Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 3-methylpentanoate Openeye Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 3-methylpentanoate CAS Name: 3-methylpentanoic acid 1-[4-(4-hexoxyphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 3-methylpentanoate Traditional Name: 3-methylvaleric acid 1-[4-(4-hexoxyphenyl)phenyl]ethyl ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CC(C)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CC(C)CC

InChI

InChI=1S/C26H36O3/c1-5-7-8-9-18-28-25-16-14-24(15-17-25)23-12-10-22(11-13-23)21(4)29-26(27)19-20(3)6-2/h10-17,20-21H,5-9,18-19H2,1-4H3