5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(o-tolyl)-5-oxo-pentanoic acid CAS Name: 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxopentanoic acid IUPAC Name: 5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(2-methylphenyl)-5-oxopentanoic acid Traditional Name: 5-[3-(4-chlorobenzyl)oxyphenyl]-5-keto-4-(o-tolyl)valeric acid Formula: C25H23ClO4 MolecularWeight: 422.90072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)O)C(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)O)C(=O)C2=CC(=CC=C2)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H23ClO4/c1-17-5-2-3-8-22(17)23(13-14-24(27)28)25(29)19-6-4-7-21(15-19)30-16-18-9-11-20(26)12-10-18/h2-12,15,23H,13-14,16H2,1H3,(H,27,28)