2-methyl-2-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[2-[4-(4-methylbenzoyl)piperazin-1-yl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[2-[4-(4-methylbenzoyl)piperazin-1-yl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[2-(4-p-toluoylpiperazino)phenoxy]propionic acid Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC(C)(C)C(=O)O

InChI

InChI=1S/C22H26N2O4/c1-16-8-10-17(11-9-16)20(25)24-14-12-23(13-15-24)18-6-4-5-7-19(18)28-22(2,3)21(26)27/h4-11H,12-15H2,1-3H3,(H,26,27)