8-(3-azanylpiperidin-1-yl)-7-(cyclopenten-1-ylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-dione

Systemtic Name: 8-(3-azanylpiperidin-1-yl)-7-(cyclopenten-1-ylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-dione Openeye Name: 8-(3-amino-1-piperidyl)-7-(cyclopenten-1-ylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-dione CAS Name: 8-(3-amino-1-piperidinyl)-7-(1-cyclopentenylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-dione IUPAC Name: 8-(3-aminopiperidin-1-yl)-7-(cyclopenten-1-ylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-dione Traditional Name: 8-(3-aminopiperidino)-7-(cyclopenten-1-ylmethyl)-1,3-dimethyl-8,9-dihydropurine-2,6-quinone Formula: C18H28N6O2 MolecularWeight: 360.45392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(N2)N3CCCC(C3)N)CC4=CCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(N2)N3CCCC(C3)N)CC4=CCCC4

InChI

InChI=1S/C18H28N6O2/c1-21-15-14(16(25)22(2)18(21)26)24(10-12-6-3-4-7-12)17(20-15)23-9-5-8-13(19)11-23/h6,13,17,20H,3-5,7-11,19H2,1-2H3