2-[(E)-1-(4-ethanoylpiperazin-1-yl)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 2-[(E)-1-(4-ethanoylpiperazin-1-yl)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione Openeye Name: 2-[(E)-1-(4-acetylpiperazin-1-yl)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione CAS Name: 2-[(E)-1-(4-acetyl-1-piperazinyl)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione IUPAC Name: 2-[(E)-1-(4-acetylpiperazin-1-yl)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione Traditional Name: 2-[(E)-1-(4-acetylpiperazino)butylideneamino]oxy-5-ethyl-3H-pyrano[2,3-d]pyrimidine-4,7-quinone Formula: C19H25N5O5 MolecularWeight: 403.4323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NOC1=NC2=C(C(=CC(=O)O2)CC)C(=O)N1)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCC/C(=N\OC1=NC2=C(C(=CC(=O)O2)CC)C(=O)N1)/N3CCN(CC3)C(=O)C

InChI

InChI=1S/C19H25N5O5/c1-4-6-14(24-9-7-23(8-10-24)12(3)25)22-29-19-20-17(27)16-13(5-2)11-15(26)28-18(16)21-19/h11H,4-10H2,1-3H3,(H,20,21,27)/b22-14+