N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,6-dimethoxy-3-nitro-benzamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,6-dimethoxy-3-nitro-benzamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,6-dimethoxy-3-nitro-benzamide CAS Name: N-[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]-2,6-dimethoxy-3-nitrobenzamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,6-dimethoxy-3-nitrobenzamide Traditional Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,6-dimethoxy-3-nitro-benzamide Formula: C18H13F6N3O6 MolecularWeight: 481.302739

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H13F6N3O6/c1-32-12-4-3-11(27(30)31)14(33-2)13(12)15(28)26-16(29)25-10-6-8(17(19,20)21)5-9(7-10)18(22,23)24/h3-7H,1-2H3,(H2,25,26,28,29)