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

Systemtic Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 4-methylhexanoate Openeye Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 4-methylhexanoate CAS Name: 4-methylhexanoic acid 1-[4-(4-hexoxyphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-hexoxyphenyl)phenyl]ethyl 4-methylhexanoate Traditional Name: 4-methylhexanoic acid 1-[4-(4-hexoxyphenyl)phenyl]ethyl ester Formula: C27H38O3 MolecularWeight: 410.58882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38O3/c1-5-7-8-9-20-29-26-17-15-25(16-18-26)24-13-11-23(12-14-24)22(4)30-27(28)19-10-21(3)6-2/h11-18,21-22H,5-10,19-20H2,1-4H3