N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]quinoxaline-2-carboxamide

Systemtic Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]quinoxaline-2-carboxamide Openeye Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]quinoxaline-2-carboxamide CAS Name: N-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-quinoxalinecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]quinoxaline-2-carboxamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-methyl-quinoxaline-2-carboxamide Formula: C17H22N5O2+ MolecularWeight: 328.38888

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C17H21N5O2/c1-20-7-9-22(10-8-20)16(23)12-21(2)17(24)15-11-18-13-5-3-4-6-14(13)19-15/h3-6,11H,7-10,12H2,1-2H3/p+1