N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)quinazolin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)quinazolin-4-yl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)quinazolin-4-yl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)-4-quinazolinyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)quinazolin-4-yl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-(trifluoromethyl)quinazolin-4-yl]isonipecotamide Formula: C22H19F3N4O3 MolecularWeight: 444.40647

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=NC(=NC5=CC=CC=C54)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=NC(=NC5=CC=CC=C54)C(F)(F)F

InChI

InChI=1S/C22H19F3N4O3/c23-22(24,25)21-27-16-4-2-1-3-15(16)19(28-21)29-9-7-13(8-10-29)20(30)26-14-5-6-17-18(11-14)32-12-31-17/h1-6,11,13H,7-10,12H2,(H,26,30)