5-(6-aminopurin-9-yl)-3-benzamido-4-oxidanyl-oxolane-2-carboxylic acid

Systemtic Name: 5-(6-aminopurin-9-yl)-3-benzamido-4-oxidanyl-oxolane-2-carboxylic acid Openeye Name: 5-(6-aminopurin-9-yl)-3-benzamido-4-hydroxy-tetrahydrofuran-2-carboxylic acid CAS Name: 5-(6-aminopurin-9-yl)-3-benzamido-4-hydroxy-2-oxolanecarboxylic acid IUPAC Name: 5-(6-aminopurin-9-yl)-3-benzamido-4-hydroxyoxolane-2-carboxylic acid Traditional Name: 5-adenin-9-yl-3-benzamido-4-hydroxy-tetrahydrofuran-2-carboxylic acid Formula: C17H16N6O5 MolecularWeight: 384.34614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2C(C(OC2C(=O)O)N3C=NC4=C3N=CN=C4N)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2C(C(OC2C(=O)O)N3C=NC4=C3N=CN=C4N)O

InChI

InChI=1S/C17H16N6O5/c18-13-10-14(20-6-19-13)23(7-21-10)16-11(24)9(12(28-16)17(26)27)22-15(25)8-4-2-1-3-5-8/h1-7,9,11-12,16,24H,(H,22,25)(H,26,27)(H2,18,19,20)