9-[5-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one

Systemtic Name: 9-[5-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one Openeye Name: 9-[5-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one CAS Name: 9-[5-(hydroxymethyl)-1-cyclohex-2-enyl]-3H-purin-6-one IUPAC Name: 9-[5-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-one Traditional Name: 9-(5-methylolcyclohex-2-en-1-yl)-3H-purin-6-one Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(CC1CO)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

C1C=CC(CC1CO)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C12H14N4O2/c17-5-8-2-1-3-9(4-8)16-7-15-10-11(16)13-6-14-12(10)18/h1,3,6-9,17H,2,4-5H2,(H,13,14,18)