1-[4-(4-pentylphenyl)phenyl]ethyl 4-methylhexanoate

Systemtic Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 4-methylhexanoate Openeye Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 4-methylhexanoate CAS Name: 4-methylhexanoic acid 1-[4-(4-pentylphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 4-methylhexanoate Traditional Name: 4-methylhexanoic acid 1-[4-(4-amylphenyl)phenyl]ethyl ester Formula: C26H36O2 MolecularWeight: 380.56284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CCC(C)CC

InChI

InChI=1S/C26H36O2/c1-5-7-8-9-22-11-13-24(14-12-22)25-17-15-23(16-18-25)21(4)28-26(27)19-10-20(3)6-2/h11-18,20-21H,5-10,19H2,1-4H3