methyl 4-[4-(2-methylpropoxy)-3-phenyl-phenyl]butanoate

Systemtic Name: methyl 4-[4-(2-methylpropoxy)-3-phenyl-phenyl]butanoate Openeye Name: methyl 4-(4-isobutoxy-3-phenyl-phenyl)butanoate CAS Name: 4-[4-(2-methylpropoxy)-3-phenylphenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(2-methylpropoxy)-3-phenylphenyl]butanoate Traditional Name: 4-(4-isobutoxy-3-phenyl-phenyl)butyric acid methyl ester Formula: C21H26O3 MolecularWeight: 326.42934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-16(2)15-24-20-13-12-17(8-7-11-21(22)23-3)14-19(20)18-9-5-4-6-10-18/h4-6,9-10,12-14,16H,7-8,11,15H2,1-3H3