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2-methyl-2-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]propanoic acid hydrobromide
2-methyl-2-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]propanoic acid hydrobromide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)(C(=O)O)NCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-].Br
Isomeric SMILES
CC(C)(C(=O)O)NCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-].Br
InChI
InChI=1S/C13H14N4O6.BrH/c1-13(2,12(20)21)14-5-6-3-7(17(22)23)4-8-9(6)16-11(19)10(18)15-8;/h3-4,14H,5H2,1-2H3,(H,15,18)(H,16,19)(H,20,21);1H
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