N-[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3,5-bis(oxidanyl)benzamide

Systemtic Name: N-[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3,5-bis(oxidanyl)benzamide Openeye Name: N-[2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-3,5-dihydroxy-benzamide CAS Name: N-[2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]-3,5-dihydroxybenzamide IUPAC Name: N-[2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-3,5-dihydroxybenzamide Traditional Name: N-(2-adenin-9-yl-4-hydroxy-5-methylol-tetrahydrofuran-3-yl)-3,5-dihydroxy-benzamide Formula: C17H18N6O6 MolecularWeight: 402.36142

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1O)O)C(=O)NC2C(C(OC2N3C=NC4=C3N=CN=C4N)CO)O

Isomeric SMILES

C1=C(C=C(C=C1O)O)C(=O)NC2C(C(OC2N3C=NC4=C3N=CN=C4N)CO)O

InChI

InChI=1S/C17H18N6O6/c18-14-12-15(20-5-19-14)23(6-21-12)17-11(13(27)10(4-24)29-17)22-16(28)7-1-8(25)3-9(26)2-7/h1-3,5-6,10-11,13,17,24-27H,4H2,(H,22,28)(H2,18,19,20)