N-[4-(cyclopropylcarbonylamino)-2-(trifluoromethyl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(cyclopropylcarbonylamino)-2-(trifluoromethyl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-[[cyclopropyl(oxo)methyl]amino]-2-(trifluoromethyl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C22H21F3N4O5 MolecularWeight: 478.42115

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C22H21F3N4O5/c23-22(24,25)16-12-15(26-20(30)13-1-2-13)4-5-17(16)27-21(31)14-3-6-18(19(11-14)29(32)33)28-7-9-34-10-8-28/h3-6,11-13H,1-2,7-10H2,(H,26,30)(H,27,31)