6-methyl-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-methyl-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2H-1,2,4-triazin-5-one Openeye Name: 3-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-2H-1,2,4-triazin-5-one Formula: C15H20N5O+ MolecularWeight: 286.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NNC(=NC1=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C15H19N5O/c1-12-14(21)16-15(18-17-12)20-9-7-19(8-10-20)11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H,16,18,21)/p+1