5-(4-methoxyphenyl)-N-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(4-methoxyphenyl)-N-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methyl]-1,2,4-triazin-3-amine Openeye Name: N-[(1-benzylpiperidin-1-ium-4-yl)methyl]-5-(4-methoxyphenyl)-N-methyl-1,2,4-triazin-3-amine CAS Name: 5-(4-methoxyphenyl)-N-methyl-N-[[1-(phenylmethyl)-4-piperidin-1-iumyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-yl)methyl]-5-(4-methoxyphenyl)-N-methyl-1,2,4-triazin-3-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)methyl-[5-(4-methoxyphenyl)-1,2,4-triazin-3-yl]-methyl-amine Formula: C24H30N5O+ MolecularWeight: 404.5279

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CC2=CC=CC=C2)C3=NC(=CN=N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(CC1CC[NH+](CC1)CC2=CC=CC=C2)C3=NC(=CN=N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N5O/c1-28(17-20-12-14-29(15-13-20)18-19-6-4-3-5-7-19)24-26-23(16-25-27-24)21-8-10-22(30-2)11-9-21/h3-11,16,20H,12-15,17-18H2,1-2H3/p+1