[4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-propylbenzoate

Systemtic Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-propylbenzoate Openeye Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-propylbenzoate CAS Name: 4-propylbenzoic acid [4-[4-(1-eicosoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-propylbenzoate Traditional Name: 4-propylbenzoic acid [4-[4-(1-arachyloxyethyl)phenyl]phenyl] ester Formula: C44H64O3 MolecularWeight: 640.97716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCC

InChI

InChI=1S/C44H64O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-36-46-37(3)39-28-30-40(31-29-39)41-32-34-43(35-33-41)47-44(45)42-26-24-38(23-5-2)25-27-42/h24-35,37H,4-23,36H2,1-3H3