potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]purin-3-ide-2,6-dione

Systemtic Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]purin-3-ide-2,6-dione Openeye Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]purin-3-ide-2,6-dione CAS Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]purin-3-ide-2,6-dione IUPAC Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]purin-3-ide-2,6-dione Traditional Name: potassium 1-cyclopropyl-7-p-anisyl-purin-3-ide-2,6-quinone Formula: C16H15KN4O3 MolecularWeight: 350.4136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=O)[N-]3)C4CC4.[K+]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=O)[N-]3)C4CC4.[K+]

InChI

InChI=1S/C16H16N4O3.K/c1-23-12-6-2-10(3-7-12)8-19-9-17-14-13(19)15(21)20(11-4-5-11)16(22)18-14;/h2-3,6-7,9,11H,4-5,8H2,1H3,(H,18,21,22);/q;+1/p-1