8-[4-(diphenylmethyl)oxypiperidin-1-yl]-1,3-dimethyl-7-propyl-purine-2,6-dione

Systemtic Name: 8-[4-(diphenylmethyl)oxypiperidin-1-yl]-1,3-dimethyl-7-propyl-purine-2,6-dione Openeye Name: 8-(4-benzhydryloxy-1-piperidyl)-1,3-dimethyl-7-propyl-purine-2,6-dione CAS Name: 8-[4-(diphenylmethyl)oxy-1-piperidinyl]-1,3-dimethyl-7-propylpurine-2,6-dione IUPAC Name: 8-(4-benzhydryloxypiperidin-1-yl)-1,3-dimethyl-7-propylpurine-2,6-dione Traditional Name: 8-(4-benzhydryloxypiperidino)-1,3-dimethyl-7-propyl-xanthine Formula: C28H33N5O3 MolecularWeight: 487.59332

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C28H33N5O3/c1-4-17-33-23-25(30(2)28(35)31(3)26(23)34)29-27(33)32-18-15-22(16-19-32)36-24(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,22,24H,4,15-19H2,1-3H3