7-(3-azanylidene-3-piperidin-1-yl-propyl)-1,3-dimethyl-purine-2,6-dione hydrochloride

Systemtic Name: 7-(3-azanylidene-3-piperidin-1-yl-propyl)-1,3-dimethyl-purine-2,6-dione hydrochloride Openeye Name: 7-[3-imino-3-(1-piperidyl)propyl]-1,3-dimethyl-purine-2,6-dione hydrochloride CAS Name: 7-[3-imino-3-(1-piperidinyl)propyl]-1,3-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 7-(3-imino-3-piperidin-1-ylpropyl)-1,3-dimethylpurine-2,6-dione hydrochloride Traditional Name: 7-(3-imino-3-piperidino-propyl)-1,3-dimethyl-xanthine hydrochloride Formula: C15H23ClN6O2 MolecularWeight: 354.83512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N6O2.ClH/c1-18-13-12(14(22)19(2)15(18)23)21(10-17-13)9-6-11(16)20-7-4-3-5-8-20;/h10,16H,3-9H2,1-2H3;1H