2-azanyl-9-[(E)-[2,2,3-tris(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(E)-[2,2,3-tris(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(E)-[2,2,3-tris(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[(E)-[2,2,3-tris(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(E)-[2,2,3-tris(hydroxymethyl)cyclopropylidene]methyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(E)-(2,2,3-trimethylolcyclopropylidene)methyl]-3H-purin-6-one Formula: C12H15N5O4 MolecularWeight: 293.2786

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C=C3C(C3(CO)CO)CO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1/C=C/3\C(C3(CO)CO)CO)NC(=NC2=O)N

InChI

InChI=1S/C12H15N5O4/c13-11-15-9-8(10(21)16-11)14-5-17(9)1-6-7(2-18)12(6,3-19)4-20/h1,5,7,18-20H,2-4H2,(H3,13,15,16,21)/b6-1+