2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-methyl-amino]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-methyl-amino]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]-methyl-amino]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]-methyl-amino]-4-nitro-isoindoline-1,3-quinone Formula: C15H8ClF3N4O4 MolecularWeight: 400.69663

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=N1)C(F)(F)F)Cl)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1=C(C=C(C=N1)C(F)(F)F)Cl)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H8ClF3N4O4/c1-21(12-9(16)5-7(6-20-12)15(17,18)19)22-13(24)8-3-2-4-10(23(26)27)11(8)14(22)25/h2-6H,1H3