7-(2-azanylethyl)-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione hydrochloride

Systemtic Name: 7-(2-azanylethyl)-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione hydrochloride Openeye Name: 7-(2-aminoethyl)-1,3-dimethyl-8-(1-piperidyl)purine-2,6-dione hydrochloride CAS Name: 7-(2-aminoethyl)-1,3-dimethyl-8-(1-piperidinyl)purine-2,6-dione hydrochloride IUPAC Name: 7-(2-aminoethyl)-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione hydrochloride Traditional Name: 7-(2-aminoethyl)-1,3-dimethyl-8-piperidino-xanthine hydrochloride Formula: C14H23ClN6O2 MolecularWeight: 342.82442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CCN.Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CCN.Cl

InChI

InChI=1S/C14H22N6O2.ClH/c1-17-11-10(12(21)18(2)14(17)22)20(9-6-15)13(16-11)19-7-4-3-5-8-19;/h3-9,15H2,1-2H3;1H