8-[cyclopentyloxy-(4-methoxyphenyl)methyl]-N,3-diethyl-purin-6-amine hydrochloride

Systemtic Name: 8-[cyclopentyloxy-(4-methoxyphenyl)methyl]-N,3-diethyl-purin-6-amine hydrochloride Openeye Name: 8-[cyclopentoxy-(4-methoxyphenyl)methyl]-N,3-diethyl-purin-6-amine hydrochloride CAS Name: 8-[cyclopentyloxy-(4-methoxyphenyl)methyl]-N,3-diethyl-6-purinamine hydrochloride IUPAC Name: 8-[cyclopentyloxy-(4-methoxyphenyl)methyl]-N,3-diethylpurin-6-amine hydrochloride Traditional Name: [8-[cyclopentoxy-(4-methoxyphenyl)methyl]-3-ethyl-purin-6-yl]-ethyl-amine hydrochloride Formula: C22H30ClN5O2 MolecularWeight: 431.9589

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=NC(=N2)C(C3=CC=C(C=C3)OC)OC4CCCC4)N(C=N1)CC.Cl

Isomeric SMILES

CCNC1=C2C(=NC(=N2)C(C3=CC=C(C=C3)OC)OC4CCCC4)N(C=N1)CC.Cl

InChI

InChI=1S/C22H29N5O2.ClH/c1-4-23-20-18-22(27(5-2)14-24-20)26-21(25-18)19(29-17-8-6-7-9-17)15-10-12-16(28-3)13-11-15;/h10-14,17,19,23H,4-9H2,1-3H3;1H