[3-(3-phenylpropoxycarbonyl)phenyl] 3-(3-methylbutoxy)benzoate

Systemtic Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-(3-methylbutoxy)benzoate Openeye Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-isopentyloxybenzoate CAS Name: 3-(3-methylbutoxy)benzoic acid [3-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-(3-methylbutoxy)benzoate Traditional Name: 3-isoamoxybenzoic acid [3-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C28H30O5 MolecularWeight: 446.5348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C28H30O5/c1-21(2)16-18-31-25-14-6-13-24(19-25)28(30)33-26-15-7-12-23(20-26)27(29)32-17-8-11-22-9-4-3-5-10-22/h3-7,9-10,12-15,19-21H,8,11,16-18H2,1-2H3