4-bromanyl-5-[2-[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]pyridazin-3-olate

Systemtic Name: 4-bromanyl-5-[2-[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]pyridazin-3-olate Openeye Name: 4-bromo-5-[2-[(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]pyridazin-3-olate CAS Name: 4-bromo-5-[(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-pyridazinolate IUPAC Name: 4-bromo-5-[2-[(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]pyridazin-3-olate Traditional Name: 4-bromo-5-[N'-[(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]pyridazin-3-olate Formula: C12H9BrN5O5- MolecularWeight: 383.13436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC2=CN=NC(=C2Br)[O-])C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CNNC2=CN=NC(=C2Br)[O-])C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN5O5/c1-23-9-3-6(2-8(11(9)19)18(21)22)4-14-16-7-5-15-17-12(20)10(7)13/h2-5,14H,1H3,(H2,16,17,20)/p-1