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

Systemtic Name: 3-[1-(4-bromophenyl)carbonylpiperidin-4-yl]-2-phenoxy-propanoic acid Openeye Name: 3-[1-(4-bromobenzoyl)-4-piperidyl]-2-phenoxy-propanoic acid CAS Name: 3-[1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]-2-phenoxypropanoic acid IUPAC Name: 3-[1-(4-bromobenzoyl)piperidin-4-yl]-2-phenoxypropanoic acid Traditional Name: 3-[1-(4-bromobenzoyl)-4-piperidyl]-2-phenoxy-propionic acid Formula: C21H22BrNO4 MolecularWeight: 432.30768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(C(=O)O)OC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1CC(C(=O)O)OC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrNO4/c22-17-8-6-16(7-9-17)20(24)23-12-10-15(11-13-23)14-19(21(25)26)27-18-4-2-1-3-5-18/h1-9,15,19H,10-14H2,(H,25,26)