2-[4-[methylamino(phenyl)methylidene]piperazine-1,4-diium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[methylamino(phenyl)methylidene]piperazine-1,4-diium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[methylamino(phenyl)methylene]piperazine-1,4-diium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[methylamino(phenyl)methylidene]-1-piperazine-1,4-diiumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[methylamino(phenyl)methylidene]piperazine-1,4-diium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[methylamino(phenyl)methylene]piperazine-1,4-diium-1-yl]-N-(p-tolyl)acetamide Formula: C21H28N4O+2 MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CC[N+](=C(C3=CC=CC=C3)NC)CC2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CC[N+](=C(C3=CC=CC=C3)NC)CC2

InChI

InChI=1S/C21H26N4O/c1-17-8-10-19(11-9-17)23-20(26)16-24-12-14-25(15-13-24)21(22-2)18-6-4-3-5-7-18/h3-11H,12-16H2,1-2H3,(H,23,26)/p+2