3-(hydroxymethyl)-5-oxidanylidene-N-prop-2-enyl-2H-1,2,5-oxadiazol-5-ium-4-carboxamide

Systemtic Name: 3-(hydroxymethyl)-5-oxidanylidene-N-prop-2-enyl-2H-1,2,5-oxadiazol-5-ium-4-carboxamide Openeye Name: N-allyl-3-(hydroxymethyl)-5-oxo-2H-1,2,5-oxadiazol-5-ium-4-carboxamide CAS Name: 3-(hydroxymethyl)-5-oxo-N-prop-2-enyl-2H-1,2,5-oxadiazol-5-ium-4-carboxamide IUPAC Name: 3-(hydroxymethyl)-5-oxo-N-prop-2-enyl-2H-1,2,5-oxadiazol-5-ium-4-carboxamide Traditional Name: N-allyl-5-keto-3-methylol-2H-furazan-5-ium-4-carboxamide Formula: C7H10N3O4+ MolecularWeight: 200.172

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=C(NO[N+]1=O)CO

Isomeric SMILES

C=CCNC(=O)C1=C(NO[N+]1=O)CO

InChI

InChI=1S/C7H9N3O4/c1-2-3-8-7(12)6-5(4-11)9-14-10(6)13/h2,11H,1,3-4H2,(H-,8,9,12,13)/p+1