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4-[(3-oxidanylpropylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione

4-[(3-oxidanylpropylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione

Systemtic Name:4-[(3-oxidanylpropylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione
Openeye Name:4-[(3-hydroxypropylamino)methylene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione
CAS Name:4-[(3-hydroxypropylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione
IUPAC Name:4-[(3-hydroxypropylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione
Traditional Name:4-[(3-hydroxypropylamino)methylene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-quinone
Formula: C20H17F3N2O3
MolecularWeight: 390.35579
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNCCCO)C(=O)N(C2=O)C3=CC=CC(=C3)C(F)(F)F


Isomeric SMILES

C1=CC=C2C(=C1)C(=CNCCCO)C(=O)N(C2=O)C3=CC=CC(=C3)C(F)(F)F


InChI

InChI=1S/C20H17F3N2O3/c21-20(22,23)13-5-3-6-14(11-13)25-18(27)16-8-2-1-7-15(16)17(19(25)28)12-24-9-4-10-26/h1-3,5-8,11-12,24,26H,4,9-10H2


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