6-(3,6-dihydro-2H-pyran-4-yl)-2-[3-(hydroxymethyl)phenyl]-7,9-dihydropurin-8-one

Systemtic Name: 6-(3,6-dihydro-2H-pyran-4-yl)-2-[3-(hydroxymethyl)phenyl]-7,9-dihydropurin-8-one Openeye Name: 6-(3,6-dihydro-2H-pyran-4-yl)-2-[3-(hydroxymethyl)phenyl]-7,9-dihydropurin-8-one CAS Name: 6-(3,6-dihydro-2H-pyran-4-yl)-2-[3-(hydroxymethyl)phenyl]-7,9-dihydropurin-8-one IUPAC Name: 6-(3,6-dihydro-2H-pyran-4-yl)-2-[3-(hydroxymethyl)phenyl]-7,9-dihydropurin-8-one Traditional Name: 6-(3,6-dihydro-2H-pyran-4-yl)-2-(3-methylolphenyl)-7,9-dihydropurin-8-one Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC=C1C2=C3C(=NC(=N2)C4=CC(=CC=C4)CO)NC(=O)N3

Isomeric SMILES

C1COCC=C1C2=C3C(=NC(=N2)C4=CC(=CC=C4)CO)NC(=O)N3

InChI

InChI=1S/C17H16N4O3/c22-9-10-2-1-3-12(8-10)15-18-13(11-4-6-24-7-5-11)14-16(20-15)21-17(23)19-14/h1-4,8,22H,5-7,9H2,(H2,18,19,20,21,23)