bis(2-chloroethyl)-methyl-[(3-methyl-2-nitro-phenyl)methyl]azanium chloride

Systemtic Name: bis(2-chloroethyl)-methyl-[(3-methyl-2-nitro-phenyl)methyl]azanium chloride Openeye Name: bis(2-chloroethyl)-methyl-[(3-methyl-2-nitro-phenyl)methyl]ammonium chloride CAS Name: bis(2-chloroethyl)-methyl-[(3-methyl-2-nitrophenyl)methyl]ammonium chloride IUPAC Name: bis(2-chloroethyl)-methyl-[(3-methyl-2-nitrophenyl)methyl]azanium chloride Traditional Name: bis(2-chloroethyl)-methyl-(3-methyl-2-nitro-benzyl)ammonium chloride Formula: C13H19Cl3N2O2 MolecularWeight: 341.66116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C[N+](C)(CCCl)CCCl)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=C(C(=CC=C1)C[N+](C)(CCCl)CCCl)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H19Cl2N2O2.ClH/c1-11-4-3-5-12(13(11)16(18)19)10-17(2,8-6-14)9-7-15;/h3-5H,6-10H2,1-2H3;1H/q+1;/p-1