7-[3-(2-ethylpiperidin-1-yl)-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[3-(2-ethylpiperidin-1-yl)-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[3-(2-ethyl-1-piperidyl)-3-oxo-propyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[3-(2-ethyl-1-piperidinyl)-3-oxopropyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[3-(2-ethylpiperidin-1-yl)-3-oxopropyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[3-(2-ethylpiperidino)-3-keto-propyl]-1,3-dimethyl-xanthine Formula: C17H25N5O3 MolecularWeight: 347.4121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCC1CCCCN1C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H25N5O3/c1-4-12-7-5-6-9-22(12)13(23)8-10-21-11-18-15-14(21)16(24)20(3)17(25)19(15)2/h11-12H,4-10H2,1-3H3