3-phenylpropyl 3-[4-(3-methylbutoxy)phenyl]carbonyloxybenzoate

Systemtic Name: 3-phenylpropyl 3-[4-(3-methylbutoxy)phenyl]carbonyloxybenzoate Openeye Name: 3-phenylpropyl 3-(4-isopentyloxybenzoyl)oxybenzoate CAS Name: 3-[[4-(3-methylbutoxy)phenyl]-oxomethoxy]benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-[4-(3-methylbutoxy)benzoyl]oxybenzoate Traditional Name: 3-(4-isoamoxybenzoyl)oxybenzoic acid 3-phenylpropyl ester Formula: C28H30O5 MolecularWeight: 446.5348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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