pentyl 2-[4-(4-octoxyphenyl)phenyl]carbonyloxybenzoate

Systemtic Name: pentyl 2-[4-(4-octoxyphenyl)phenyl]carbonyloxybenzoate Openeye Name: pentyl 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoate CAS Name: 2-[[4-(4-octoxyphenyl)phenyl]-oxomethoxy]benzoic acid pentyl ester IUPAC Name: pentyl 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoate Traditional Name: 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoic acid amyl ester Formula: C33H40O5 MolecularWeight: 516.6677

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OCCCCC

InChI

InChI=1S/C33H40O5/c1-3-5-7-8-9-13-24-36-29-22-20-27(21-23-29)26-16-18-28(19-17-26)32(34)38-31-15-11-10-14-30(31)33(35)37-25-12-6-4-2/h10-11,14-23H,3-9,12-13,24-25H2,1-2H3