N'-(4-ethyl-2-nitro-phenyl)propane-1,3-diamine hydrochloride

Systemtic Name: N'-(4-ethyl-2-nitro-phenyl)propane-1,3-diamine hydrochloride Openeye Name: N'-(4-ethyl-2-nitro-phenyl)propane-1,3-diamine hydrochloride CAS Name: N'-(4-ethyl-2-nitrophenyl)propane-1,3-diamine hydrochloride IUPAC Name: N'-(4-ethyl-2-nitrophenyl)propane-1,3-diamine hydrochloride Traditional Name: 3-aminopropyl-(4-ethyl-2-nitro-phenyl)amine hydrochloride Formula: C11H18ClN3O2 MolecularWeight: 259.73252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NCCCN)[N+](=O)[O-].Cl

Isomeric SMILES

CCC1=CC(=C(C=C1)NCCCN)[N+](=O)[O-].Cl

InChI

InChI=1S/C11H17N3O2.ClH/c1-2-9-4-5-10(13-7-3-6-12)11(8-9)14(15)16;/h4-5,8,13H,2-3,6-7,12H2,1H3;1H