2-bromanyl-6-[(Z)-C-methyl-N-(pyridin-2-ylcarbonylamino)carbonimidoyl]-4-nitro-phenolate

Systemtic Name: 2-bromanyl-6-[(Z)-C-methyl-N-(pyridin-2-ylcarbonylamino)carbonimidoyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[(Z)-C-methyl-N-(pyridine-2-carbonylamino)carbonimidoyl]-4-nitro-phenolate CAS Name: 2-bromo-4-nitro-6-[(1Z)-1-[[oxo(2-pyridinyl)methyl]hydrazinylidene]ethyl]phenolate IUPAC Name: 2-bromo-6-[(Z)-C-methyl-N-(pyridine-2-carbonylamino)carbonimidoyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[(Z)-C-methyl-N-picolinamido-carbonimidoyl]-4-nitro-phenolate Formula: C14H10BrN4O4- MolecularWeight: 378.1576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=N1)C2=CC(=CC(=C2[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CC=N1)/C2=CC(=CC(=C2[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrN4O4/c1-8(17-18-14(21)12-4-2-3-5-16-12)10-6-9(19(22)23)7-11(15)13(10)20/h2-7,20H,1H3,(H,18,21)/p-1/b17-8-