3-[[(2E)-2-hydroxyiminoethanoyl]amino]propyl-dimethyl-(phenylmethyl)azanium iodide

Systemtic Name: 3-[[(2E)-2-hydroxyiminoethanoyl]amino]propyl-dimethyl-(phenylmethyl)azanium iodide Openeye Name: benzyl-[3-[[(2E)-2-hydroxyiminoacetyl]amino]propyl]-dimethyl-ammonium iodide CAS Name: 3-[[(2E)-2-hydroxyimino-1-oxoethyl]amino]propyl-dimethyl-(phenylmethyl)ammonium iodide IUPAC Name: benzyl-[3-[[(2E)-2-hydroxyiminoacetyl]amino]propyl]-dimethylazanium iodide Traditional Name: benzyl-[3-[[(2E)-2-hydroximinoacetyl]amino]propyl]-dimethyl-ammonium iodide Formula: C14H22IN3O2 MolecularWeight: 391.24785

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCNC(=O)C=NO)CC1=CC=CC=C1.[I-]

Isomeric SMILES

C[N+](C)(CCCNC(=O)/C=N/O)CC1=CC=CC=C1.[I-]

InChI

InChI=1S/C14H21N3O2.HI/c1-17(2,12-13-7-4-3-5-8-13)10-6-9-15-14(18)11-16-19;/h3-5,7-8,11H,6,9-10,12H2,1-2H3,(H-,15,18,19);1H