(4-butoxycarbonylphenyl) 3-bromanyl-4-hexoxy-benzoate

Systemtic Name: (4-butoxycarbonylphenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: (4-butoxycarbonylphenyl) 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid (4-butoxycarbonylphenyl) ester Formula: C24H29BrO5 MolecularWeight: 477.38806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCC)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCC)Br

InChI

InChI=1S/C24H29BrO5/c1-3-5-7-8-16-28-22-14-11-19(17-21(22)25)24(27)30-20-12-9-18(10-13-20)23(26)29-15-6-4-2/h9-14,17H,3-8,15-16H2,1-2H3