2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone

Systemtic Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Openeye Name: 2-[4-(o-tolylmethyl)piperazine-1,4-diium-1-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone CAS Name: 2-[4-[(2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone IUPAC Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Traditional Name: 2-[4-(2-methylbenzyl)piperazine-1,4-diium-1-yl]-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethanone Formula: C25H33N3O+2 MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)N3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)N3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O/c1-21-7-5-6-10-24(21)19-26-15-17-27(18-16-26)20-25(29)28-13-11-23(12-14-28)22-8-3-2-4-9-22/h2-11H,12-20H2,1H3/p+2