2-[6-[4-(diphenylmethyl)piperazin-1-yl]purin-9-yl]ethanol dihydrochloride

Systemtic Name: 2-[6-[4-(diphenylmethyl)piperazin-1-yl]purin-9-yl]ethanol dihydrochloride Openeye Name: 2-[6-(4-benzhydrylpiperazin-1-yl)purin-9-yl]ethanol dihydrochloride CAS Name: 2-[6-[4-(diphenylmethyl)-1-piperazinyl]-9-purinyl]ethanol dihydrochloride IUPAC Name: 2-[6-(4-benzhydrylpiperazin-1-yl)purin-9-yl]ethanol dihydrochloride Traditional Name: 2-[6-(4-benzhydrylpiperazino)purin-9-yl]ethanol dihydrochloride Formula: C24H28Cl2N6O MolecularWeight: 487.42472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2N=CN3CCO)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2N=CN3CCO)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C24H26N6O.2ClH/c31-16-15-30-18-27-21-23(25-17-26-24(21)30)29-13-11-28(12-14-29)22(19-7-3-1-4-8-19)20-9-5-2-6-10-20;;/h1-10,17-18,22,31H,11-16H2;2*1H