2-(3-methoxyphenyl)-1-oxidanylidene-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide

Systemtic Name: 2-(3-methoxyphenyl)-1-oxidanylidene-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide Openeye Name: 2-(3-methoxyphenyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide CAS Name: 2-(3-methoxyphenyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]-4-isoquinolinecarboxamide IUPAC Name: 2-(3-methoxyphenyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide Traditional Name: 1-keto-2-(3-methoxyphenyl)-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide Formula: C24H17F3N2O3 MolecularWeight: 438.39859

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H17F3N2O3/c1-32-18-9-5-8-17(13-18)29-14-21(19-10-2-3-11-20(19)23(29)31)22(30)28-16-7-4-6-15(12-16)24(25,26)27/h2-14H,1H3,(H,28,30)