1-[4-(4-hexylphenyl)phenyl]ethyl 5-methyldecanoate

Systemtic Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 5-methyldecanoate Openeye Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 5-methyldecanoate CAS Name: 5-methyldecanoic acid 1-[4-(4-hexylphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 5-methyldecanoate Traditional Name: 5-methylcapric acid 1-[4-(4-hexylphenyl)phenyl]ethyl ester Formula: C31H46O2 MolecularWeight: 450.69574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CCCC(C)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)CCCC(C)CCCCC

InChI

InChI=1S/C31H46O2/c1-5-7-9-11-15-27-17-19-29(20-18-27)30-23-21-28(22-24-30)26(4)33-31(32)16-12-14-25(3)13-10-8-6-2/h17-26H,5-16H2,1-4H3