[4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl] 4-octanoyloxybenzoate

Systemtic Name: [4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl] 4-octanoyloxybenzoate Openeye Name: [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] 4-octanoyloxybenzoate CAS Name: 4-(1-oxooctoxy)benzoic acid [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] ester IUPAC Name: [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] 4-octanoyloxybenzoate Traditional Name: 4-caprylyloxybenzoic acid [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] ester Formula: C32H37BrO5 MolecularWeight: 581.53718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)Br

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)Br

InChI

InChI=1S/C32H37BrO5/c1-4-6-7-8-9-10-31(34)37-27-18-13-25(14-19-27)32(35)38-28-16-11-24(12-17-28)26-15-20-30(29(33)21-26)36-22-23(3)5-2/h11-21,23H,4-10,22H2,1-3H3