2-[3-[1-(4-bromophenyl)carbonylpiperidin-4-yl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[3-[1-(4-bromophenyl)carbonylpiperidin-4-yl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[3-[1-(4-bromobenzoyl)-4-piperidyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[3-[1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[1-(4-bromobenzoyl)piperidin-4-yl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[3-[1-(4-bromobenzoyl)-4-piperidyl]phenoxy]-2-methyl-propionic acid Formula: C22H24BrNO4 MolecularWeight: 446.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrNO4/c1-22(2,21(26)27)28-19-5-3-4-17(14-19)15-10-12-24(13-11-15)20(25)16-6-8-18(23)9-7-16/h3-9,14-15H,10-13H2,1-2H3,(H,26,27)