2-azanyl-7-[3-(hydroxymethyl)-4-oxidanyl-butyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-7-[3-(hydroxymethyl)-4-oxidanyl-butyl]-3H-purin-6-one Openeye Name: 2-amino-7-[4-hydroxy-3-(hydroxymethyl)butyl]-3H-purin-6-one CAS Name: 2-amino-7-[4-hydroxy-3-(hydroxymethyl)butyl]-3H-purin-6-one IUPAC Name: 2-amino-7-[4-hydroxy-3-(hydroxymethyl)butyl]-3H-purin-6-one Traditional Name: 2-amino-7-(4-hydroxy-3-methylol-butyl)-3H-purin-6-one Formula: C10H15N5O3 MolecularWeight: 253.2578

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCC(CO)CO)C(=O)N=C(N2)N

Isomeric SMILES

C1=NC2=C(N1CCC(CO)CO)C(=O)N=C(N2)N

InChI

InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)15(5-12-8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18)