1-[4-(4-octylphenyl)phenyl]ethyl 2-octoxypropanoate

Systemtic Name: 1-[4-(4-octylphenyl)phenyl]ethyl 2-octoxypropanoate Openeye Name: 1-[4-(4-octylphenyl)phenyl]ethyl 2-octoxypropanoate CAS Name: 2-octoxypropanoic acid 1-[4-(4-octylphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-octylphenyl)phenyl]ethyl 2-octoxypropanoate Traditional Name: 2-octoxypropionic acid 1-[4-(4-octylphenyl)phenyl]ethyl ester Formula: C33H50O3 MolecularWeight: 494.7483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)OC(=O)C(C)OCCCCCCCC

InChI

InChI=1S/C33H50O3/c1-5-7-9-11-13-15-17-29-18-20-31(21-19-29)32-24-22-30(23-25-32)27(3)36-33(34)28(4)35-26-16-14-12-10-8-6-2/h18-25,27-28H,5-17,26H2,1-4H3