(2-oxidanylidene-3,7-dihydropurin-6-yl) pyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-3,7-dihydropurin-6-yl) pyridine-3-carboxylate Openeye Name: (2-oxo-3,7-dihydropurin-6-yl) pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid (2-oxo-3,7-dihydropurin-6-yl) ester IUPAC Name: (2-oxo-3,7-dihydropurin-6-yl) pyridine-3-carboxylate Traditional Name: nicotinic acid (2-keto-3,7-dihydropurin-6-yl) ester Formula: C11H7N5O3 MolecularWeight: 257.20498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OC2=NC(=O)NC3=C2NC=N3

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OC2=NC(=O)NC3=C2NC=N3

InChI

InChI=1S/C11H7N5O3/c17-10(6-2-1-3-12-4-6)19-9-7-8(14-5-13-7)15-11(18)16-9/h1-5H,(H2,13,14,15,16,18)