3-azanyl-3-[(5-fluoranyl-1H-indol-3-yl)methyl]-4-oxidanyl-2-purin-9-yl-oxolane-2-carboxylic acid

Systemtic Name: 3-azanyl-3-[(5-fluoranyl-1H-indol-3-yl)methyl]-4-oxidanyl-2-purin-9-yl-oxolane-2-carboxylic acid Openeye Name: 3-amino-3-[(5-fluoro-1H-indol-3-yl)methyl]-4-hydroxy-2-purin-9-yl-tetrahydrofuran-2-carboxylic acid CAS Name: 3-amino-3-[(5-fluoro-1H-indol-3-yl)methyl]-4-hydroxy-2-(9-purinyl)-2-oxolanecarboxylic acid IUPAC Name: 3-amino-3-[(5-fluoro-1H-indol-3-yl)methyl]-4-hydroxy-2-purin-9-yloxolane-2-carboxylic acid Traditional Name: 3-amino-3-[(5-fluoro-1H-indol-3-yl)methyl]-4-hydroxy-2-purin-9-yl-tetrahydrofuran-2-carboxylic acid Formula: C19H17FN6O4 MolecularWeight: 412.374483

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(O1)(C(=O)O)N2C=NC3=CN=CN=C32)(CC4=CNC5=C4C=C(C=C5)F)N)O

Isomeric SMILES

C1C(C(C(O1)(C(=O)O)N2C=NC3=CN=CN=C32)(CC4=CNC5=C4C=C(C=C5)F)N)O

InChI

InChI=1S/C19H17FN6O4/c20-11-1-2-13-12(3-11)10(5-23-13)4-18(21)15(27)7-30-19(18,17(28)29)26-9-25-14-6-22-8-24-16(14)26/h1-3,5-6,8-9,15,23,27H,4,7,21H2,(H,28,29)