1-(4-octylphenyl)ethyl 4-(4-octoxyphenyl)benzoate

Systemtic Name: 1-(4-octylphenyl)ethyl 4-(4-octoxyphenyl)benzoate Openeye Name: 1-(4-octylphenyl)ethyl 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid 1-(4-octylphenyl)ethyl ester IUPAC Name: 1-(4-octylphenyl)ethyl 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid 1-(4-octylphenyl)ethyl ester Formula: C37H50O3 MolecularWeight: 542.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C37H50O3/c1-4-6-8-10-12-14-16-31-17-19-32(20-18-31)30(3)40-37(38)35-23-21-33(22-24-35)34-25-27-36(28-26-34)39-29-15-13-11-9-7-5-2/h17-28,30H,4-16,29H2,1-3H3