8-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[4-(4-methoxybenzoyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[4-(4-methoxybenzoyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(4-p-anisoylpiperazino)-7H-purine-2,6-quinone Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C19H22N6O4/c1-22-15-14(17(27)23(2)19(22)28)20-18(21-15)25-10-8-24(9-11-25)16(26)12-4-6-13(29-3)7-5-12/h4-7H,8-11H2,1-3H3,(H,20,21)