9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-8-phenylazanyl-3H-purin-6-one

Systemtic Name: 9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-8-phenylazanyl-3H-purin-6-one Openeye Name: 8-anilino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 8-anilino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 8-anilino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 8-anilino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-3H-purin-6-one Formula: C16H17N5O5 MolecularWeight: 359.33668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC3=C(N2C4C(C(C(O4)CO)O)O)NC=NC3=O

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC3=C(N2C4C(C(C(O4)CO)O)O)NC=NC3=O

InChI

InChI=1S/C16H17N5O5/c22-6-9-11(23)12(24)15(26-9)21-13-10(14(25)18-7-17-13)20-16(21)19-8-4-2-1-3-5-8/h1-5,7,9,11-12,15,22-24H,6H2,(H,19,20)(H,17,18,25)