4-(pyrrolidin-1-ylmethylidene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-dione

Systemtic Name: 4-(pyrrolidin-1-ylmethylidene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-dione Openeye Name: 4-(pyrrolidin-1-ylmethylene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-dione CAS Name: 4-(1-pyrrolidinylmethylidene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-dione IUPAC Name: 4-(pyrrolidin-1-ylmethylidene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-dione Traditional Name: 4-(pyrrolidinomethylene)-2-[2-(trifluoromethyl)phenyl]isoquinoline-1,3-quinone Formula: C21H17F3N2O2 MolecularWeight: 386.36709

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H17F3N2O2/c22-21(23,24)17-9-3-4-10-18(17)26-19(27)15-8-2-1-7-14(15)16(20(26)28)13-25-11-5-6-12-25/h1-4,7-10,13H,5-6,11-12H2