(3E)-1-ethyl-3-(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)urea

Systemtic Name: (3E)-1-ethyl-3-(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)urea Openeye Name: (3E)-1-ethyl-3-(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)urea CAS Name: (3E)-1-ethyl-3-(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)urea IUPAC Name: (3E)-1-ethyl-3-(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)urea Traditional Name: (3E)-1-ethyl-3-(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)urea Formula: C10H11N5O3 MolecularWeight: 249.22604

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N=C1N=[N+](C2=CC=CC=C2N1O)[O-]

Isomeric SMILES

CCNC(=O)/N=C/1\N=[N+](C2=CC=CC=C2N1O)[O-]

InChI

InChI=1S/C10H11N5O3/c1-2-11-10(16)12-9-13-15(18)8-6-4-3-5-7(8)14(9)17/h3-6,17H,2H2,1H3,(H,11,16)/b12-9+