2-chloranyl-N1-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-5-nitro-benzene-1,4-diamine chloride

Systemtic Name: 2-chloranyl-N1-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-5-nitro-benzene-1,4-diamine chloride Openeye Name: 2-chloro-N1-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-5-nitro-benzene-1,4-diamine chloride CAS Name: 2-chloro-N1-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-5-nitrobenzene-1,4-diamine chloride IUPAC Name: 2-chloro-1-N-[2-(3-methyl-2H-imidazol-1-yl)ethyl]-5-nitrobenzene-1,4-diamine chloride Traditional Name: (4-amino-2-chloro-5-nitro-phenyl)-[2-(3-methyl-4-imidazolin-1-yl)ethyl]amine chloride Formula: C12H16Cl2N5O2- MolecularWeight: 333.19374

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C=C1)CCNC2=CC(=C(C=C2Cl)N)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CN1CN(C=C1)CCNC2=CC(=C(C=C2Cl)N)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C12H16ClN5O2.ClH/c1-16-4-5-17(8-16)3-2-15-11-7-12(18(19)20)10(14)6-9(11)13;/h4-7,15H,2-3,8,14H2,1H3;1H/p-1