6-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(2R)-2-p-phenetylpyrrolidin-1-ium-1-yl]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C22H27N6O+ MolecularWeight: 391.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCC[NH+]2CC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C22H26N6O/c1-2-29-18-12-10-16(11-13-18)19-9-6-14-28(19)15-20-25-21(23)27-22(26-20)24-17-7-4-3-5-8-17/h3-5,7-8,10-13,19H,2,6,9,14-15H2,1H3,(H3,23,24,25,26,27)/p+1/t19-/m1/s1