2,2-diphenyl-1-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2,2-diphenyl-1-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2,2-diphenyl-1-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2,2-diphenyl-1-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2,2-diphenyl-1-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2,2-diphenyl-1-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C24H26N3O+ MolecularWeight: 372.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=CC=C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=CC=C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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