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

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-bromanyl-2,6-dimethoxy-5-nitro-benzamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-bromo-2,6-dimethoxy-5-nitro-benzamide CAS Name: N-[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]-3-bromo-2,6-dimethoxy-5-nitrobenzamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-bromo-2,6-dimethoxy-5-nitrobenzamide Traditional Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-bromo-2,6-dimethoxy-5-nitro-benzamide Formula: C18H12BrF6N3O6 MolecularWeight: 560.198799

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C18H12BrF6N3O6/c1-33-13-10(19)6-11(28(31)32)14(34-2)12(13)15(29)27-16(30)26-9-4-7(17(20,21)22)3-8(5-9)18(23,24)25/h3-6H,1-2H3,(H2,26,27,29,30)