N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine hydrochloride

Systemtic Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine hydrochloride Openeye Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine hydrochloride CAS Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine hydrochloride IUPAC Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine hydrochloride Traditional Name: 3-aminopropyl-[2-nitro-4-(trifluoromethyl)phenyl]amine hydrochloride Formula: C10H13ClF3N3O2 MolecularWeight: 299.67733

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCN.Cl

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCN.Cl

InChI

InChI=1S/C10H12F3N3O2.ClH/c11-10(12,13)7-2-3-8(15-5-1-4-14)9(6-7)16(17)18;/h2-3,6,15H,1,4-5,14H2;1H