6-nitro-3-oxidanylidene-7-[5-(propan-2-ylcarbamoyloxymethyl)-1H-imidazol-2-yl]-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 6-nitro-3-oxidanylidene-7-[5-(propan-2-ylcarbamoyloxymethyl)-1H-imidazol-2-yl]-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[5-(isopropylcarbamoyloxymethyl)-1H-imidazol-2-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 6-nitro-3-oxo-7-[5-[[oxo-(propan-2-ylamino)methoxy]methyl]-1H-imidazol-2-yl]-4H-quinoxaline-2-carboxylic acid IUPAC Name: 6-nitro-3-oxo-7-[5-(propan-2-ylcarbamoyloxymethyl)-1H-imidazol-2-yl]-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[5-(isopropylcarbamoyloxymethyl)-1H-imidazol-2-yl]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C17H16N6O7 MolecularWeight: 416.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)OCC1=CN=C(N1)C2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=N3)C(=O)O

Isomeric SMILES

CC(C)NC(=O)OCC1=CN=C(N1)C2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=N3)C(=O)O

InChI

InChI=1S/C17H16N6O7/c1-7(2)19-17(27)30-6-8-5-18-14(20-8)9-3-10-11(4-12(9)23(28)29)22-15(24)13(21-10)16(25)26/h3-5,7H,6H2,1-2H3,(H,18,20)(H,19,27)(H,22,24)(H,25,26)