6-(4-azanyl-2-oxidanyl-phenyl)-2-oxidanylidene-1,2,3-triazinan-2-ium-4-one

Systemtic Name: 6-(4-azanyl-2-oxidanyl-phenyl)-2-oxidanylidene-1,2,3-triazinan-2-ium-4-one Openeye Name: 6-(4-amino-2-hydroxy-phenyl)-2-oxo-triazinan-2-ium-4-one CAS Name: 6-(4-amino-2-hydroxyphenyl)-2-oxo-4-triazinan-2-iumone IUPAC Name: 6-(4-amino-2-hydroxyphenyl)-2-oxotriazinan-2-ium-4-one Traditional Name: 6-(4-amino-2-hydroxy-phenyl)-2-keto-triazinan-2-ium-4-one Formula: C9H11N4O3+ MolecularWeight: 223.20864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N[N+](=O)NC1=O)C2=C(C=C(C=C2)N)O

Isomeric SMILES

C1C(N[N+](=O)NC1=O)C2=C(C=C(C=C2)N)O

InChI

InChI=1S/C9H10N4O3/c10-5-1-2-6(8(14)3-5)7-4-9(15)12-13(16)11-7/h1-3,7H,4,10H2,(H2-,11,12,14,15,16)/p+1