N-[9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]-9,10-bis(oxidanylidene)anthracene-2-carboxamide

Systemtic Name: N-[9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]-9,10-bis(oxidanylidene)anthracene-2-carboxamide Openeye Name: N-[9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]-9,10-dioxo-anthracene-2-carboxamide CAS Name: N-[9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]-9,10-dioxo-2-anthracenecarboxamide IUPAC Name: N-[9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-9,10-dioxoanthracene-2-carboxamide Traditional Name: N-[9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)purin-6-yl]-9,10-diketo-anthracene-2-carboxamide Formula: C25H19N5O6 MolecularWeight: 485.44826

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6C5=O)CO)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6C5=O)CO)O

InChI

InChI=1S/C25H19N5O6/c31-9-18-17(32)8-19(36-18)30-11-28-20-23(26-10-27-24(20)30)29-25(35)12-5-6-15-16(7-12)22(34)14-4-2-1-3-13(14)21(15)33/h1-7,10-11,17-19,31-32H,8-9H2,(H,26,27,29,35)