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2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-3-ium-8-yl]phenoxy]ethanamide

2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-3-ium-8-yl]phenoxy]ethanamide

Systemtic Name:2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-3-ium-8-yl]phenoxy]ethanamide
Openeye Name:2-[4-(1,3-dimethyl-2,6-dioxo-purin-3-ium-8-yl)phenoxy]acetamide
CAS Name:2-[4-(1,3-dimethyl-2,6-dioxo-8-purin-3-iumyl)phenoxy]acetamide
IUPAC Name:2-[4-(1,3-dimethyl-2,6-dioxopurin-3-ium-8-yl)phenoxy]acetamide
Traditional Name:2-[4-(2,6-diketo-1,3-dimethyl-purin-3-ium-8-yl)phenoxy]acetamide
Formula: C15H14N5O4+
MolecularWeight: 328.30276
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=NC(=NC2=[N+](C1=O)C)C3=CC=C(C=C3)OCC(=O)N


Isomeric SMILES

CN1C(=O)C2=NC(=NC2=[N+](C1=O)C)C3=CC=C(C=C3)OCC(=O)N


InChI

InChI=1S/C15H13N5O4/c1-19-13-11(14(22)20(2)15(19)23)17-12(18-13)8-3-5-9(6-4-8)24-7-10(16)21/h3-6H,7H2,1-2H3,(H-,16,21)/p+1


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