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

Systemtic Name: [4-(2-phenoxyethoxycarbonyl)phenyl] 3-bromanyl-4-(3-methylbutoxy)benzoate Openeye Name: [4-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-isopentyloxy-benzoate CAS Name: 3-bromo-4-(3-methylbutoxy)benzoic acid [4-[oxo(2-phenoxyethoxy)methyl]phenyl] ester IUPAC Name: [4-(2-phenoxyethoxycarbonyl)phenyl] 3-bromo-4-(3-methylbutoxy)benzoate Traditional Name: 3-bromo-4-isoamoxy-benzoic acid [4-(2-phenoxyethoxycarbonyl)phenyl] ester Formula: C27H27BrO6 MolecularWeight: 527.40368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCOC3=CC=CC=C3)Br

InChI

InChI=1S/C27H27BrO6/c1-19(2)14-15-32-25-13-10-21(18-24(25)28)27(30)34-23-11-8-20(9-12-23)26(29)33-17-16-31-22-6-4-3-5-7-22/h3-13,18-19H,14-17H2,1-2H3