2-(2-azanyl-4-methyl-1-phenyl-2-pyridin-3-yl-piperazin-1-ium-1-yl)ethanamide

Systemtic Name: 2-(2-azanyl-4-methyl-1-phenyl-2-pyridin-3-yl-piperazin-1-ium-1-yl)ethanamide Openeye Name: 2-[2-amino-4-methyl-1-phenyl-2-(3-pyridyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[2-amino-4-methyl-1-phenyl-2-(3-pyridinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(2-amino-4-methyl-1-phenyl-2-pyridin-3-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: 2-[2-amino-4-methyl-1-phenyl-2-(3-pyridyl)piperazin-1-ium-1-yl]acetamide Formula: C18H24N5O+ MolecularWeight: 326.41606

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](C(C1)(C2=CN=CC=C2)N)(CC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN1CC[N+](C(C1)(C2=CN=CC=C2)N)(CC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H23N5O/c1-22-10-11-23(13-17(19)24,16-7-3-2-4-8-16)18(20,14-22)15-6-5-9-21-12-15/h2-9,12H,10-11,13-14,20H2,1H3,(H-,19,24)/p+1