1,3-dimethyl-8-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-[4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-7H-purine-2,6-dione Traditional Name: 8-[4-(2-keto-2-piperidino-ethoxy)phenyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC(=O)N4CCCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC(=O)N4CCCCC4

InChI

InChI=1S/C20H23N5O4/c1-23-18-16(19(27)24(2)20(23)28)21-17(22-18)13-6-8-14(9-7-13)29-12-15(26)25-10-4-3-5-11-25/h6-9H,3-5,10-12H2,1-2H3,(H,21,22)