1-methyl-N2-[(2R)-1-phenylpropan-2-yl]-7H-purin-1-ium-2,6-diamine

Systemtic Name: 1-methyl-N2-[(2R)-1-phenylpropan-2-yl]-7H-purin-1-ium-2,6-diamine Openeye Name: 1-methyl-N2-[(1R)-1-methyl-2-phenyl-ethyl]-7H-purin-1-ium-2,6-diamine CAS Name: 1-methyl-N2-[(2R)-1-phenylpropan-2-yl]-7H-purin-1-ium-2,6-diamine IUPAC Name: 1-methyl-2-N-[(2R)-1-phenylpropan-2-yl]-7H-purin-1-ium-2,6-diamine Traditional Name: (6-amino-1-methyl-7H-purin-1-ium-2-yl)-[(1R)-1-methyl-2-phenyl-ethyl]amine Formula: C15H19N6+ MolecularWeight: 283.35156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NC2=NC3=C(C(=[N+]2C)N)NC=N3

Isomeric SMILES

C[C@H](CC1=CC=CC=C1)NC2=NC3=C(C(=[N+]2C)N)NC=N3

InChI

InChI=1S/C15H18N6/c1-10(8-11-6-4-3-5-7-11)19-15-20-14-12(17-9-18-14)13(16)21(15)2/h3-7,9-10H,8H2,1-2H3,(H3,16,17,18,19,20)/p+1/t10-/m1/s1