5-bromanyl-N-[(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino]-2-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-N-[(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino]-2-oxidanyl-benzamide Openeye Name: 5-bromo-2-hydroxy-N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]benzamide CAS Name: 5-bromo-2-hydroxy-N-[(E)-1-(5-nitro-2-tetrazolyl)propan-2-ylideneamino]benzamide IUPAC Name: 5-bromo-2-hydroxy-N-[(E)-1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]benzamide Traditional Name: 5-bromo-2-hydroxy-N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]benzamide Formula: C11H10BrN7O4 MolecularWeight: 384.1456

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C=CC(=C1)Br)O)CN2N=C(N=N2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C=CC(=C1)Br)O)/CN2N=C(N=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H10BrN7O4/c1-6(5-18-16-11(15-17-18)19(22)23)13-14-10(21)8-4-7(12)2-3-9(8)20/h2-4,20H,5H2,1H3,(H,14,21)/b13-6+