N-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-3-(2-isoquinolin-4-ylethyl)benzamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-3-(2-isoquinolin-4-ylethyl)benzamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-[2-(4-isoquinolyl)ethyl]benzamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-[2-(4-isoquinolinyl)ethyl]benzamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-(2-isoquinolin-4-ylethyl)benzamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-[2-(4-isoquinolyl)ethyl]benzamide Formula: C25H18F2N2O3 MolecularWeight: 432.418826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC=C2CCC3=CC=CC(=C3)C(=O)NC4=C5C(=CC=C4)OC(O5)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=NC=C2CCC3=CC=CC(=C3)C(=O)NC4=C5C(=CC=C4)OC(O5)(F)F

InChI

InChI=1S/C25H18F2N2O3/c26-25(27)31-22-10-4-9-21(23(22)32-25)29-24(30)17-7-3-5-16(13-17)11-12-19-15-28-14-18-6-1-2-8-20(18)19/h1-10,13-15H,11-12H2,(H,29,30)