9-[3-(1H-indol-3-yl)propyl]-1-methyl-purin-1-ium-6-amine

Systemtic Name: 9-[3-(1H-indol-3-yl)propyl]-1-methyl-purin-1-ium-6-amine Openeye Name: 9-[3-(1H-indol-3-yl)propyl]-1-methyl-purin-1-ium-6-amine CAS Name: 9-[3-(1H-indol-3-yl)propyl]-1-methyl-6-purin-1-iumamine IUPAC Name: 9-[3-(1H-indol-3-yl)propyl]-1-methylpurin-1-ium-6-amine Traditional Name: [9-[3-(1H-indol-3-yl)propyl]-1-methyl-purin-1-ium-6-yl]amine Formula: C17H19N6+ MolecularWeight: 307.37296

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=C(N=C1)N(C=N2)CCCC3=CNC4=CC=CC=C43)N

Isomeric SMILES

C[N+]1=C(C2=C(N=C1)N(C=N2)CCCC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C17H18N6/c1-22-10-21-17-15(16(22)18)20-11-23(17)8-4-5-12-9-19-14-7-3-2-6-13(12)14/h2-3,6-7,9-11,18-19H,4-5,8H2,1H3/p+1