9-[3-[4-(phenoxymethyl)piperidin-1-yl]propyl]-N-propyl-purin-6-amine

Systemtic Name: 9-[3-[4-(phenoxymethyl)piperidin-1-yl]propyl]-N-propyl-purin-6-amine Openeye Name: 9-[3-[4-(phenoxymethyl)-1-piperidyl]propyl]-N-propyl-purin-6-amine CAS Name: 9-[3-[4-(phenoxymethyl)-1-piperidinyl]propyl]-N-propyl-6-purinamine IUPAC Name: 9-[3-[4-(phenoxymethyl)piperidin-1-yl]propyl]-N-propylpurin-6-amine Traditional Name: [9-[3-[4-(phenoxymethyl)piperidino]propyl]purin-6-yl]-propyl-amine Formula: C23H32N6O MolecularWeight: 408.53978

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC2=C1N=CN2CCCN3CCC(CC3)COC4=CC=CC=C4

Isomeric SMILES

CCCNC1=NC=NC2=C1N=CN2CCCN3CCC(CC3)COC4=CC=CC=C4

InChI

InChI=1S/C23H32N6O/c1-2-11-24-22-21-23(26-17-25-22)29(18-27-21)13-6-12-28-14-9-19(10-15-28)16-30-20-7-4-3-5-8-20/h3-5,7-8,17-19H,2,6,9-16H2,1H3,(H,24,25,26)