dimethyl-[3-[[(2R)-3-(3-nitrophenoxy)-2-oxidanyl-propyl]azaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[[(2R)-3-(3-nitrophenoxy)-2-oxidanyl-propyl]azaniumyl]propyl]azanium Openeye Name: 3-[[(2R)-2-hydroxy-3-(3-nitrophenoxy)propyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(2R)-2-hydroxy-3-(3-nitrophenoxy)propyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(2R)-2-hydroxy-3-(3-nitrophenoxy)propyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(2R)-2-hydroxy-3-(3-nitrophenoxy)propyl]ammonio]propyl-dimethyl-ammonium Formula: C14H25N3O4+2 MolecularWeight: 299.366

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC(COC1=CC=CC(=C1)[N+](=O)[O-])O

Isomeric SMILES

C[NH+](C)CCC[NH2+]C[C@H](COC1=CC=CC(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C14H23N3O4/c1-16(2)8-4-7-15-10-13(18)11-21-14-6-3-5-12(9-14)17(19)20/h3,5-6,9,13,15,18H,4,7-8,10-11H2,1-2H3/p+2/t13-/m1/s1