(4-ethoxy-3-nitro-phenyl)methyl-bis(2-hydroxyethyl)azanium chloride

Systemtic Name: (4-ethoxy-3-nitro-phenyl)methyl-bis(2-hydroxyethyl)azanium chloride Openeye Name: (4-ethoxy-3-nitro-phenyl)methyl-bis(2-hydroxyethyl)ammonium chloride CAS Name: (4-ethoxy-3-nitrophenyl)methyl-bis(2-hydroxyethyl)ammonium chloride IUPAC Name: (4-ethoxy-3-nitrophenyl)methyl-bis(2-hydroxyethyl)azanium chloride Traditional Name: (4-ethoxy-3-nitro-benzyl)-bis(2-hydroxyethyl)ammonium chloride Formula: C13H21ClN2O5 MolecularWeight: 320.76924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](CCO)CCO)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](CCO)CCO)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H20N2O5.ClH/c1-2-20-13-4-3-11(9-12(13)15(18)19)10-14(5-7-16)6-8-17;/h3-4,9,16-17H,2,5-8,10H2,1H3;1H