bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrazol-4-yl)methyl]azanium chloride

Systemtic Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrazol-4-yl)methyl]azanium chloride Openeye Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrazol-4-yl)methyl]ammonium chloride CAS Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-4-pyrazolyl)methyl]ammonium chloride IUPAC Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitropyrazol-4-yl)methyl]azanium chloride Traditional Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrazol-4-yl)methyl]ammonium chloride Formula: C10H17Cl3N4O2 MolecularWeight: 331.62658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C[N+](C)(CCCl)CCCl)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CN1C(=C(C=N1)C[N+](C)(CCCl)CCCl)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C10H17Cl2N4O2.ClH/c1-14-10(15(17)18)9(7-13-14)8-16(2,5-3-11)6-4-12;/h7H,3-6,8H2,1-2H3;1H/q+1;/p-1