2-[4,5-bis(oxidanylidene)-1,3,5-triazinan-5-ium-2-yl]ethanoic acid

Systemtic Name: 2-[4,5-bis(oxidanylidene)-1,3,5-triazinan-5-ium-2-yl]ethanoic acid Openeye Name: 2-(4,5-dioxo-1,3,5-triazinan-5-ium-2-yl)acetic acid CAS Name: 2-(4,5-dioxo-1,3,5-triazinan-5-ium-2-yl)acetic acid IUPAC Name: 2-(4,5-dioxo-1,3,5-triazinan-5-ium-2-yl)acetic acid Traditional Name: 2-(4,5-diketo-1,3,5-triazinan-5-ium-2-yl)acetic acid Formula: C5H8N3O4+ MolecularWeight: 174.13472

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(NC(=O)[N+]1=O)CC(=O)O

Isomeric SMILES

C1NC(NC(=O)[N+]1=O)CC(=O)O

InChI

InChI=1S/C5H7N3O4/c9-4(10)1-3-6-2-8(12)5(11)7-3/h3,6H,1-2H2,(H-,7,9,10,11)/p+1