N-[8-[2-(hydroxymethyl)-3-oxidanyl-propoxy]-9-methyl-purin-6-yl]benzamide

Systemtic Name: N-[8-[2-(hydroxymethyl)-3-oxidanyl-propoxy]-9-methyl-purin-6-yl]benzamide Openeye Name: N-[8-[3-hydroxy-2-(hydroxymethyl)propoxy]-9-methyl-purin-6-yl]benzamide CAS Name: N-[8-[3-hydroxy-2-(hydroxymethyl)propoxy]-9-methyl-6-purinyl]benzamide IUPAC Name: N-[8-[3-hydroxy-2-(hydroxymethyl)propoxy]-9-methylpurin-6-yl]benzamide Traditional Name: N-[8-(3-hydroxy-2-methylol-propoxy)-9-methyl-purin-6-yl]benzamide Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)NC(=O)C3=CC=CC=C3)N=C1OCC(CO)CO

Isomeric SMILES

CN1C2=C(C(=NC=N2)NC(=O)C3=CC=CC=C3)N=C1OCC(CO)CO

InChI

InChI=1S/C17H19N5O4/c1-22-15-13(20-17(22)26-9-11(7-23)8-24)14(18-10-19-15)21-16(25)12-5-3-2-4-6-12/h2-6,10-11,23-24H,7-9H2,1H3,(H,18,19,21,25)