[3-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(2-methylpropoxy)benzoate

Systemtic Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(2-methylpropoxy)benzoate Openeye Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-isobutoxy-benzoate CAS Name: 3-bromo-4-(2-methylpropoxy)benzoic acid [3-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-(2-methylpropoxy)benzoate Traditional Name: 3-bromo-4-isobutoxy-benzoic acid [3-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C27H27BrO5 MolecularWeight: 511.40428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)Br

InChI

InChI=1S/C27H27BrO5/c1-19(2)18-32-25-14-13-22(17-24(25)28)27(30)33-23-12-6-11-21(16-23)26(29)31-15-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-14,16-17,19H,7,10,15,18H2,1-2H3