potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]-6-oxidanylidene-purin-2-olate

Systemtic Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]-6-oxidanylidene-purin-2-olate Openeye Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]-6-oxo-purin-2-olate CAS Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]-6-oxo-2-purinolate IUPAC Name: potassium 1-cyclopropyl-7-[(4-methoxyphenyl)methyl]-6-oxopurin-2-olate Traditional Name: potassium 1-cyclopropyl-6-keto-7-p-anisyl-purin-2-olate 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(=N3)[O-])C4CC4.[K+]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=N3)[O-])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,18,22);/q;+1/p-1