1-methyl-2-[2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]imidazol-4-olate

Systemtic Name: 1-methyl-2-[2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]imidazol-4-olate Openeye Name: 1-methyl-2-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]imidazol-4-olate CAS Name: 1-methyl-2-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-4-imidazololate IUPAC Name: 1-methyl-2-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]imidazol-4-olate Traditional Name: 2-[[2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetyl]amino]-1-methyl-imidazol-4-olate Formula: C14H12N5O6- MolecularWeight: 346.27498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CN1C=C(N=C1NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C14H13N5O6/c1-17-5-11(20)15-14(17)16-12(21)6-18-9-4-8(19(23)24)2-3-10(9)25-7-13(18)22/h2-5,20H,6-7H2,1H3,(H,15,16,21)/p-1