1-(1,3-benzoxazol-2-yl)-N-[4-bromanyl-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[4-bromanyl-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[4-bromo-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[4-bromo-3-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[4-bromo-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[4-bromo-3-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H17BrF3N3O2 MolecularWeight: 468.26709

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H17BrF3N3O2/c21-15-6-5-13(11-14(15)20(22,23)24)25-18(28)12-7-9-27(10-8-12)19-26-16-3-1-2-4-17(16)29-19/h1-6,11-12H,7-10H2,(H,25,28)