4-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-methyl-2-(N'-methylcarbamimidoyl)-N-nitro-benzamide

Systemtic Name: 4-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-methyl-2-(N'-methylcarbamimidoyl)-N-nitro-benzamide Openeye Name: 4-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methyl-2-(N'-methylcarbamimidoyl)-N-nitro-benzamide CAS Name: 2-[amino(methylimino)methyl]-4-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methyl-N-nitrobenzamide IUPAC Name: 4-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methyl-2-(N'-methylcarbamimidoyl)-N-nitrobenzamide Traditional Name: 4-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methyl-2-(N'-methylamidino)-N-nitro-benzamide Formula: C17H14ClF3N4O4 MolecularWeight: 430.76567

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)N(C)[N+](=O)[O-])N

Isomeric SMILES

CN=C(C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)N(C)[N+](=O)[O-])N

InChI

InChI=1S/C17H14ClF3N4O4/c1-23-15(22)12-8-10(4-5-11(12)16(26)24(2)25(27)28)29-14-6-3-9(7-13(14)18)17(19,20)21/h3-8H,1-2H3,(H2,22,23)