N-(2-azanyl-2-oxidanylidene-ethyl)-4-(3-oxidanylidene-4,5-dihydro-2H-1,2,3-triazin-3-ium-6-yl)benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-4-(3-oxidanylidene-4,5-dihydro-2H-1,2,3-triazin-3-ium-6-yl)benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzamide CAS Name: N-(2-amino-2-oxoethyl)-4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzamide Traditional Name: N-(2-amino-2-keto-ethyl)-4-(3-keto-4,5-dihydro-2H-triazin-3-ium-6-yl)benzamide Formula: C12H14N5O3+ MolecularWeight: 276.27126

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=O)NN=C1C2=CC=C(C=C2)C(=O)NCC(=O)N

Isomeric SMILES

C1C[N+](=O)NN=C1C2=CC=C(C=C2)C(=O)NCC(=O)N

InChI

InChI=1S/C12H13N5O3/c13-11(18)7-14-12(19)9-3-1-8(2-4-9)10-5-6-17(20)16-15-10/h1-4H,5-7H2,(H3-,13,14,16,18,19,20)/p+1