N-(3-morpholin-4-ium-4-ylpropyl)-4-nitro-2-(trifluoromethyl)aniline

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-nitro-2-(trifluoromethyl)aniline Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-nitro-2-(trifluoromethyl)aniline CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-4-nitro-2-(trifluoromethyl)aniline IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-nitro-2-(trifluoromethyl)aniline Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[4-nitro-2-(trifluoromethyl)phenyl]amine Formula: C14H19F3N3O3+ MolecularWeight: 334.31417

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H18F3N3O3/c15-14(16,17)12-10-11(20(21)22)2-3-13(12)18-4-1-5-19-6-8-23-9-7-19/h2-3,10,18H,1,4-9H2/p+1