N-[3-[[(2Z)-2-hydroxyimino-2-phenyl-ethanoyl]amino]propyl]-4-methyl-pyrazin-4-ium-2-carboxamide

Systemtic Name: N-[3-[[(2Z)-2-hydroxyimino-2-phenyl-ethanoyl]amino]propyl]-4-methyl-pyrazin-4-ium-2-carboxamide Openeye Name: N-[3-[[(2Z)-2-hydroxyimino-2-phenyl-acetyl]amino]propyl]-4-methyl-pyrazin-4-ium-2-carboxamide CAS Name: N-[3-[[(2Z)-2-hydroxyimino-1-oxo-2-phenylethyl]amino]propyl]-4-methyl-2-pyrazin-4-iumcarboxamide IUPAC Name: N-[3-[[(2Z)-2-hydroxyimino-2-phenylacetyl]amino]propyl]-4-methylpyrazin-4-ium-2-carboxamide Traditional Name: N-[3-[[(2Z)-2-hydroximino-2-phenyl-acetyl]amino]propyl]-4-methyl-pyrazin-4-ium-2-carboxamide Formula: C17H20N5O3+ MolecularWeight: 342.3724

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=NC=C1)C(=O)NCCCNC(=O)C(=NO)C2=CC=CC=C2

Isomeric SMILES

C[N+]1=CC(=NC=C1)C(=O)NCCCNC(=O)/C(=N\O)/C2=CC=CC=C2

InChI

InChI=1S/C17H19N5O3/c1-22-11-10-18-14(12-22)16(23)19-8-5-9-20-17(24)15(21-25)13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H2-,19,20,23,24,25)/p+1