7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride

Systemtic Name: 7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride Openeye Name: 7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride CAS Name: 7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride Traditional Name: 7-[2-(2,6-dimethylheptylamino)ethyl]-1,3-dimethyl-xanthine hydrochloride Formula: C18H32ClN5O2 MolecularWeight: 385.93198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl

Isomeric SMILES

CC(C)CCCC(C)CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl

InChI

InChI=1S/C18H31N5O2.ClH/c1-13(2)7-6-8-14(3)11-19-9-10-23-12-20-16-15(23)17(24)22(5)18(25)21(16)4;/h12-14,19H,6-11H2,1-5H3;1H