[4-(2-octoxypropoxy)phenyl] 4-(4-dodecoxyphenyl)benzoate

Systemtic Name: [4-(2-octoxypropoxy)phenyl] 4-(4-dodecoxyphenyl)benzoate Openeye Name: [4-(2-octoxypropoxy)phenyl] 4-(4-dodecoxyphenyl)benzoate CAS Name: 4-(4-dodecoxyphenyl)benzoic acid [4-(2-octoxypropoxy)phenyl] ester IUPAC Name: [4-(2-octoxypropoxy)phenyl] 4-(4-dodecoxyphenyl)benzoate Traditional Name: 4-(4-lauryloxyphenyl)benzoic acid [4-(2-octoxypropoxy)phenyl] ester Formula: C42H60O5 MolecularWeight: 644.9228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCC(C)OCCCCCCCC

InChI

InChI=1S/C42H60O5/c1-4-6-8-10-12-13-14-15-17-19-33-45-39-26-24-37(25-27-39)36-20-22-38(23-21-36)42(43)47-41-30-28-40(29-31-41)46-34-35(3)44-32-18-16-11-9-7-5-2/h20-31,35H,4-19,32-34H2,1-3H3