N1,N4-dimethyl-N4-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-2-nitro-benzene-1,4-diamine chloride hydrate

Systemtic Name: N1,N4-dimethyl-N4-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-2-nitro-benzene-1,4-diamine chloride hydrate Openeye Name: N1,N4-dimethyl-N4-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-2-nitro-benzene-1,4-diamine chloride hydrate CAS Name: N1,N4-dimethyl-N4-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-2-nitrobenzene-1,4-diamine chloride hydrate IUPAC Name: 1-N,4-N-dimethyl-4-N-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-2-nitrobenzene-1,4-diamine chloride hydrate Traditional Name: methyl-[4-(methylamino)-3-nitro-phenyl]-[2-(3-methyl-4-imidazolin-1-yl)ethyl]amine chloride hydrate Formula: C14H23ClN5O3- MolecularWeight: 344.81712

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)N(C)CCN2CN(C=C2)C)[N+](=O)[O-].O.[Cl-]

Isomeric SMILES

CNC1=C(C=C(C=C1)N(C)CCN2CN(C=C2)C)[N+](=O)[O-].O.[Cl-]

InChI

InChI=1S/C14H21N5O2.ClH.H2O/c1-15-13-5-4-12(10-14(13)19(20)21)17(3)7-9-18-8-6-16(2)11-18;;/h4-6,8,10,15H,7,9,11H2,1-3H3;1H;1H2/p-1