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

Systemtic Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-nitrophenyl)ethanamide Openeye Name: N-(2-nitrophenyl)-2-[4-(o-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-nitrophenyl)acetamide Traditional Name: 2-[4-(2-methylbenzyl)piperazine-1,4-diium-1-yl]-N-(2-nitrophenyl)acetamide Formula: C20H26N4O3+2 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-16-6-2-3-7-17(16)14-22-10-12-23(13-11-22)15-20(25)21-18-8-4-5-9-19(18)24(26)27/h2-9H,10-15H2,1H3,(H,21,25)/p+2