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[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl pyridine-3-carboxylate

[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl pyridine-3-carboxylate

Systemtic Name:[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]methyl pyridine-3-carboxylate
Openeye Name:(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)methyl pyridine-3-carboxylate
CAS Name:3-pyridinecarboxylic acid (1,3,7-trimethyl-2,6-dioxo-8-purinyl)methyl ester
IUPAC Name:(1,3,7-trimethyl-2,6-dioxopurin-8-yl)methyl pyridine-3-carboxylate
Traditional Name:nicotinic acid (2,6-diketo-1,3,7-trimethyl-purin-8-yl)methyl ester
Formula: C15H15N5O4
MolecularWeight: 329.3107
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)COC(=O)C3=CN=CC=C3


Isomeric SMILES

CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)COC(=O)C3=CN=CC=C3


InChI

InChI=1S/C15H15N5O4/c1-18-10(8-24-14(22)9-5-4-6-16-7-9)17-12-11(18)13(21)20(3)15(23)19(12)2/h4-7H,8H2,1-3H3


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