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

Systemtic Name: [2-(2-phenoxyethoxycarbonyl)phenyl] 3-bromanyl-4-hexoxy-benzoate Openeye Name: [2-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid [2-[oxo(2-phenoxyethoxy)methyl]phenyl] ester IUPAC Name: [2-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid [2-(2-phenoxyethoxycarbonyl)phenyl] ester Formula: C28H29BrO6 MolecularWeight: 541.43026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)OCCOC3=CC=CC=C3)Br

InChI

InChI=1S/C28H29BrO6/c1-2-3-4-10-17-33-26-16-15-21(20-24(26)29)27(30)35-25-14-9-8-13-23(25)28(31)34-19-18-32-22-11-6-5-7-12-22/h5-9,11-16,20H,2-4,10,17-19H2,1H3