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

Systemtic Name: bis(2-chloroethyl)-[(3-methoxy-2-nitro-phenyl)methyl]-methyl-azanium chloride Openeye Name: bis(2-chloroethyl)-[(3-methoxy-2-nitro-phenyl)methyl]-methyl-ammonium chloride CAS Name: bis(2-chloroethyl)-[(3-methoxy-2-nitrophenyl)methyl]-methylammonium chloride IUPAC Name: bis(2-chloroethyl)-[(3-methoxy-2-nitrophenyl)methyl]-methylazanium chloride Traditional Name: bis(2-chloroethyl)-(3-methoxy-2-nitro-benzyl)-methyl-ammonium chloride Formula: C13H19Cl3N2O3 MolecularWeight: 357.66056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19Cl2N2O3.ClH/c1-17(8-6-14,9-7-15)10-11-4-3-5-12(20-2)13(11)16(18)19;/h3-5H,6-10H2,1-2H3;1H/q+1;/p-1