2-[3-(4-chlorophenyl)-5-propoxy-phenyl]-3-methyl-butanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]-3-methyl-butanoic acid Openeye Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]-3-methyl-butanoic acid CAS Name: 2-[3-(4-chlorophenyl)-5-propoxyphenyl]-3-methylbutanoic acid IUPAC Name: 2-[3-(4-chlorophenyl)-5-propoxyphenyl]-3-methylbutanoic acid Traditional Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]-3-methyl-butyric acid Formula: C20H23ClO3 MolecularWeight: 346.84782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC(=C1)C(C(C)C)C(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCOC1=CC(=CC(=C1)C(C(C)C)C(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClO3/c1-4-9-24-18-11-15(14-5-7-17(21)8-6-14)10-16(12-18)19(13(2)3)20(22)23/h5-8,10-13,19H,4,9H2,1-3H3,(H,22,23)