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

Systemtic Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrrol-2-yl)methyl]azanium chloride Openeye Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrrol-2-yl)methyl]ammonium chloride CAS Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-2-pyrrolyl)methyl]ammonium chloride IUPAC Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitropyrrol-2-yl)methyl]azanium chloride Traditional Name: bis(2-chloroethyl)-methyl-[(1-methyl-5-nitro-pyrrol-2-yl)methyl]ammonium chloride Formula: C11H18Cl3N3O2 MolecularWeight: 330.63852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1[N+](=O)[O-])C[N+](C)(CCCl)CCCl.[Cl-]

Isomeric SMILES

CN1C(=CC=C1[N+](=O)[O-])C[N+](C)(CCCl)CCCl.[Cl-]

InChI

InChI=1S/C11H18Cl2N3O2.ClH/c1-14-10(3-4-11(14)15(17)18)9-16(2,7-5-12)8-6-13;/h3-4H,5-9H2,1-2H3;1H/q+1;/p-1