7-[(E)-but-2-enyl]-3-methyl-8-piperidin-1-yl-purine-2,6-dione

Systemtic Name: 7-[(E)-but-2-enyl]-3-methyl-8-piperidin-1-yl-purine-2,6-dione Openeye Name: 7-[(E)-but-2-enyl]-3-methyl-8-(1-piperidyl)purine-2,6-dione CAS Name: 7-[(E)-but-2-enyl]-3-methyl-8-(1-piperidinyl)purine-2,6-dione IUPAC Name: 7-[(E)-but-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione Traditional Name: 7-[(E)-but-2-enyl]-3-methyl-8-piperidino-xanthine Formula: C15H21N5O2 MolecularWeight: 303.35954

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C2=C(N=C1N3CCCCC3)N(C(=O)NC2=O)C

Isomeric SMILES

C/C=C/CN1C2=C(N=C1N3CCCCC3)N(C(=O)NC2=O)C

InChI

InChI=1S/C15H21N5O2/c1-3-4-10-20-11-12(18(2)15(22)17-13(11)21)16-14(20)19-8-6-5-7-9-19/h3-4H,5-10H2,1-2H3,(H,17,21,22)/b4-3+