N-[azanyl-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]benzamide

Systemtic Name: N-[azanyl-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]benzamide Openeye Name: N-[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]benzamide CAS Name: N-[amino-(4-methyl-1-piperazine-1,4-diiumylidene)methyl]benzamide IUPAC Name: N-[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]benzamide Traditional Name: N-[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]benzamide Formula: C13H20N4O+2 MolecularWeight: 248.3241

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[N+](=C(N)NC(=O)C2=CC=CC=C2)CC1

Isomeric SMILES

C[NH+]1CC[N+](=C(N)NC(=O)C2=CC=CC=C2)CC1

InChI

InChI=1S/C13H18N4O/c1-16-7-9-17(10-8-16)13(14)15-12(18)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,14,15,18)/p+2