4-fluoranyl-3-(isoquinolin-4-ylmethoxy)-N-[4-morpholin-4-yl-3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-fluoranyl-3-(isoquinolin-4-ylmethoxy)-N-[4-morpholin-4-yl-3-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-fluoro-3-(4-isoquinolylmethoxy)-N-[4-morpholino-3-(trifluoromethyl)phenyl]benzamide CAS Name: 4-fluoro-3-(4-isoquinolinylmethoxy)-N-[4-(4-morpholinyl)-3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-fluoro-3-(isoquinolin-4-ylmethoxy)-N-[4-morpholin-4-yl-3-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-fluoro-3-(4-isoquinolylmethoxy)-N-[4-morpholino-3-(trifluoromethyl)phenyl]benzamide Formula: C28H23F4N3O3 MolecularWeight: 525.494133

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)F)OCC4=CN=CC5=CC=CC=C54)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)F)OCC4=CN=CC5=CC=CC=C54)C(F)(F)F

InChI

InChI=1S/C28H23F4N3O3/c29-24-7-5-18(13-26(24)38-17-20-16-33-15-19-3-1-2-4-22(19)20)27(36)34-21-6-8-25(23(14-21)28(30,31)32)35-9-11-37-12-10-35/h1-8,13-16H,9-12,17H2,(H,34,36)