5-(3,4-dimethoxyphenyl)-N-methyl-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(3,4-dimethoxyphenyl)-N-methyl-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(3,4-dimethoxyphenyl)-N-methyl-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2,4-triazin-3-amine CAS Name: 5-(3,4-dimethoxyphenyl)-N-methyl-N-[[(2S)-1-methyl-2-pyrrolidin-1-iumyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(3,4-dimethoxyphenyl)-N-methyl-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]-methyl-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]amine Formula: C18H26N5O2+ MolecularWeight: 344.43134

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1CN(C)C2=NC(=CN=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+]1CCC[C@H]1CN(C)C2=NC(=CN=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H25N5O2/c1-22-9-5-6-14(22)12-23(2)18-20-15(11-19-21-18)13-7-8-16(24-3)17(10-13)25-4/h7-8,10-11,14H,5-6,9,12H2,1-4H3/p+1/t14-/m0/s1