bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitro-pyrrol-3-yl)methyl]azanium chloride

Systemtic Name: bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitro-pyrrol-3-yl)methyl]azanium chloride Openeye Name: bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitro-pyrrol-3-yl)methyl]ammonium chloride CAS Name: bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitro-3-pyrrolyl)methyl]ammonium chloride IUPAC Name: bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitropyrrol-3-yl)methyl]azanium chloride Traditional Name: bis(2-hydroxyethyl)-methyl-[(1-methyl-2-nitro-pyrrol-3-yl)methyl]ammonium chloride Formula: C11H20ClN3O4 MolecularWeight: 293.7472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20N3O4.ClH/c1-12-4-3-10(11(12)13(17)18)9-14(2,5-7-15)6-8-16;/h3-4,15-16H,5-9H2,1-2H3;1H/q+1;/p-1