1-[4-(4-hexylphenyl)phenyl]ethyl 7-methyldodecanoate

Systemtic Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 7-methyldodecanoate Openeye Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 7-methyldodecanoate CAS Name: 7-methyldodecanoic acid 1-[4-(4-hexylphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-hexylphenyl)phenyl]ethyl 7-methyldodecanoate Traditional Name: 7-methyllauric acid 1-[4-(4-hexylphenyl)phenyl]ethyl ester Formula: C33H50O2 MolecularWeight: 478.7489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H50O2/c1-5-7-9-13-17-29-19-21-31(22-20-29)32-25-23-30(24-26-32)28(4)35-33(34)18-14-10-12-16-27(3)15-11-8-6-2/h19-28H,5-18H2,1-4H3