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

Systemtic Name: 4-(2-methylphenyl)-5-[3-(2-methylpropoxy)phenyl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3-isobutoxyphenyl)-4-(o-tolyl)-5-oxo-pentanoic acid CAS Name: 4-(2-methylphenyl)-5-[3-(2-methylpropoxy)phenyl]-5-oxopentanoic acid IUPAC Name: 4-(2-methylphenyl)-5-[3-(2-methylpropoxy)phenyl]-5-oxopentanoic acid Traditional Name: 5-(3-isobutoxyphenyl)-5-keto-4-(o-tolyl)valeric acid Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)O)C(=O)C2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)O)C(=O)C2=CC(=CC=C2)OCC(C)C

InChI

InChI=1S/C22H26O4/c1-15(2)14-26-18-9-6-8-17(13-18)22(25)20(11-12-21(23)24)19-10-5-4-7-16(19)3/h4-10,13,15,20H,11-12,14H2,1-3H3,(H,23,24)