6-nitro-3-oxidanylidene-7-[4-(phenylcarbamoyloxymethyl)imidazol-1-yl]-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 6-nitro-3-oxidanylidene-7-[4-(phenylcarbamoyloxymethyl)imidazol-1-yl]-4H-quinoxaline-2-carboxylic acid Openeye Name: 6-nitro-3-oxo-7-[4-(phenylcarbamoyloxymethyl)imidazol-1-yl]-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[4-[[anilino(oxo)methoxy]methyl]-1-imidazolyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 6-nitro-3-oxo-7-[4-(phenylcarbamoyloxymethyl)imidazol-1-yl]-4H-quinoxaline-2-carboxylic acid Traditional Name: 3-keto-6-nitro-7-[4-(phenylcarbamoyloxymethyl)imidazol-1-yl]-4H-quinoxaline-2-carboxylic acid Formula: C20H14N6O7 MolecularWeight: 450.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H14N6O7/c27-18-17(19(28)29)23-13-6-15(16(26(31)32)7-14(13)24-18)25-8-12(21-10-25)9-33-20(30)22-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,22,30)(H,24,27)(H,28,29)