1-(4-octylphenyl)ethyl 4-octoxybenzoate

Systemtic Name: 1-(4-octylphenyl)ethyl 4-octoxybenzoate Openeye Name: 1-(4-octylphenyl)ethyl 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid 1-(4-octylphenyl)ethyl ester IUPAC Name: 1-(4-octylphenyl)ethyl 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid 1-(4-octylphenyl)ethyl ester Formula: C31H46O3 MolecularWeight: 466.69514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H46O3/c1-4-6-8-10-12-14-16-27-17-19-28(20-18-27)26(3)34-31(32)29-21-23-30(24-22-29)33-25-15-13-11-9-7-5-2/h17-24,26H,4-16,25H2,1-3H3