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

Systemtic Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[4-(1-eicosoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[4-(1-arachyloxyethyl)phenyl]phenyl] ester Formula: C45H66O4 MolecularWeight: 671.00314

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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)OCCCC

Isomeric SMILES

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

InChI

InChI=1S/C45H66O4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-37-47-38(3)39-24-26-40(27-25-39)41-28-34-44(35-29-41)49-45(46)42-30-32-43(33-31-42)48-36-7-5-2/h24-35,38H,4-23,36-37H2,1-3H3