1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-nitro-4-(trifluoromethyl)anilino]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-nitro-4-(trifluoromethyl)anilino]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-nitro-4-(trifluoromethyl)anilino]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-nitro-4-(trifluoromethyl)anilino]ethanone Formula: C18H16F3N3O3 MolecularWeight: 379.33315

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16F3N3O3/c19-18(20,21)14-5-6-15(16(9-14)24(26)27)22-10-17(25)23-8-7-12-3-1-2-4-13(12)11-23/h1-6,9,22H,7-8,10-11H2