[3-(2-phenoxyethoxycarbonyl)phenyl] 3-bromanyl-4-butoxy-benzoate

Systemtic Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 3-bromanyl-4-butoxy-benzoate Openeye Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid [3-[oxo(2-phenoxyethoxy)methyl]phenyl] ester IUPAC Name: [3-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid [3-(2-phenoxyethoxycarbonyl)phenyl] ester Formula: C26H25BrO6 MolecularWeight: 513.3771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCOC3=CC=CC=C3)Br

InChI

InChI=1S/C26H25BrO6/c1-2-3-14-31-24-13-12-20(18-23(24)27)26(29)33-22-11-7-8-19(17-22)25(28)32-16-15-30-21-9-5-4-6-10-21/h4-13,17-18H,2-3,14-16H2,1H3