(Z)-but-2-enedioic acid; 6-methyl-2-piperazin-1-yl-7H-pyrrolo[3,4-d]pyrimidin-5-one

Systemtic Name: (Z)-but-2-enedioic acid; 6-methyl-2-piperazin-1-yl-7H-pyrrolo[3,4-d]pyrimidin-5-one Openeye Name: maleic acid; 6-methyl-2-piperazin-1-yl-7H-pyrrolo[3,4-d]pyrimidin-5-one CAS Name: (Z)-2-butenedioic acid; 6-methyl-2-(1-piperazinyl)-7H-pyrrolo[3,4-d]pyrimidin-5-one IUPAC Name: (Z)-but-2-enedioic acid; 6-methyl-2-piperazin-1-yl-7H-pyrrolo[3,4-d]pyrimidin-5-one Traditional Name: maleic acid; 6-methyl-2-piperazino-7H-pyrrolo[3,4-d]pyrimidin-5-one Formula: C15H19N5O5 MolecularWeight: 349.34186

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=NC(=NC=C2C1=O)N3CCNCC3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CC2=NC(=NC=C2C1=O)N3CCNCC3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C11H15N5O.C4H4O4/c1-15-7-9-8(10(15)17)6-13-11(14-9)16-4-2-12-3-5-16;5-3(6)1-2-4(7)8/h6,12H,2-5,7H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-