9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-phenylazanyl-3H-purin-6-one

Systemtic Name: 9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-phenylazanyl-3H-purin-6-one Openeye Name: 2-anilino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-anilino-9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-anilino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-anilino-9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-3H-purin-6-one Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4=CC=CC=C4)CO)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4=CC=CC=C4)CO)O

InChI

InChI=1S/C16H17N5O4/c22-7-11-10(23)6-12(25-11)21-8-17-13-14(21)19-16(20-15(13)24)18-9-4-2-1-3-5-9/h1-5,8,10-12,22-23H,6-7H2,(H2,18,19,20,24)