2-(2-bromanylpiperidin-1-yl)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propanoic acid

Systemtic Name: 2-(2-bromanylpiperidin-1-yl)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propanoic acid Openeye Name: 2-(2-bromo-1-piperidyl)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propanoic acid CAS Name: 2-(2-bromo-1-piperidinyl)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propanoic acid IUPAC Name: 2-(2-bromopiperidin-1-yl)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propanoic acid Traditional Name: 2-(2-bromopiperidino)-3-(4-fluorophenyl)-2-(2H-indazol-3-yl)propionic acid Formula: C21H21BrFN3O2 MolecularWeight: 446.312743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)Br)C(CC2=CC=C(C=C2)F)(C3=C4C=CC=CC4=NN3)C(=O)O

Isomeric SMILES

C1CCN(C(C1)Br)C(CC2=CC=C(C=C2)F)(C3=C4C=CC=CC4=NN3)C(=O)O

InChI

InChI=1S/C21H21BrFN3O2/c22-18-7-3-4-12-26(18)21(20(27)28,13-14-8-10-15(23)11-9-14)19-16-5-1-2-6-17(16)24-25-19/h1-2,5-6,8-11,18H,3-4,7,12-13H2,(H,24,25)(H,27,28)