N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [4-(morpholin-4-ium-4-ylmethyl)benzyl]-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C19H21F3N3O3+ MolecularWeight: 396.38355

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H20F3N3O3/c20-19(21,22)16-5-6-17(18(11-16)25(26)27)23-12-14-1-3-15(4-2-14)13-24-7-9-28-10-8-24/h1-6,11,23H,7-10,12-13H2/p+1