2,2-diphenyl-1-[4-(pyridin-1-ium-2-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2,2-diphenyl-1-[4-(pyridin-1-ium-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2,2-diphenyl-1-[4-(pyridin-1-ium-2-ylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2,2-diphenyl-1-[4-(2-pyridin-1-iumylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2,2-diphenyl-1-[4-(pyridin-1-ium-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2,2-diphenyl-1-[4-(pyridin-1-ium-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C24H27N3O+2 MolecularWeight: 373.49068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=[NH+]2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=[NH+]2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O/c28-24(23(20-9-3-1-4-10-20)21-11-5-2-6-12-21)27-17-15-26(16-18-27)19-22-13-7-8-14-25-22/h1-14,23H,15-19H2/p+2