2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(Z)-1-pyridin-4-ylethylideneamino]ethanamide

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(Z)-1-pyridin-4-ylethylideneamino]ethanamide Openeye Name: 2-[4-(p-tolylmethyl)piperazine-1,4-diium-1-yl]-N-[(Z)-1-(4-pyridyl)ethylideneamino]acetamide CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[(Z)-1-pyridin-4-ylethylideneamino]acetamide IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(Z)-1-pyridin-4-ylethylideneamino]acetamide Traditional Name: 2-[4-(4-methylbenzyl)piperazine-1,4-diium-1-yl]-N-[(Z)-1-(4-pyridyl)ethylideneamino]acetamide Formula: C21H29N5O+2 MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O/c1-17-3-5-19(6-4-17)15-25-11-13-26(14-12-25)16-21(27)24-23-18(2)20-7-9-22-10-8-20/h3-10H,11-16H2,1-2H3,(H,24,27)/p+2/b23-18-