N-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-(trifluoromethyl)benzimidazol-4-yl]-2-nitro-benzamide

Systemtic Name: N-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-(trifluoromethyl)benzimidazol-4-yl]-2-nitro-benzamide Openeye Name: N-[1-(2-morpholino-2-oxo-ethyl)-2-(trifluoromethyl)benzimidazol-4-yl]-2-nitro-benzamide CAS Name: N-[1-[2-(4-morpholinyl)-2-oxoethyl]-2-(trifluoromethyl)-4-benzimidazolyl]-2-nitrobenzamide IUPAC Name: N-[1-(2-morpholin-4-yl-2-oxoethyl)-2-(trifluoromethyl)benzimidazol-4-yl]-2-nitrobenzamide Traditional Name: N-[1-(2-keto-2-morpholino-ethyl)-2-(trifluoromethyl)benzimidazol-4-yl]-2-nitro-benzamide Formula: C21H18F3N5O5 MolecularWeight: 477.39333

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C3=C(C(=CC=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-])N=C2C(F)(F)F

Isomeric SMILES

C1COCCN1C(=O)CN2C3=C(C(=CC=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-])N=C2C(F)(F)F

InChI

InChI=1S/C21H18F3N5O5/c22-21(23,24)20-26-18-14(25-19(31)13-4-1-2-6-15(13)29(32)33)5-3-7-16(18)28(20)12-17(30)27-8-10-34-11-9-27/h1-7H,8-12H2,(H,25,31)