2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-nitro-phenolate

Systemtic Name: 2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-nitro-phenolate Openeye Name: 2-[(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-nitro-phenolate CAS Name: 2-[(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-nitrophenolate IUPAC Name: 2-[(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-nitrophenolate Traditional Name: 2-[(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-nitro-phenolate Formula: C13H7BrN3O6- MolecularWeight: 381.11518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Br)[O-]

InChI

InChI=1S/C13H8BrN3O6/c14-8-3-7(13(19)11(4-8)17(22)23)6-15-10-5-9(16(20)21)1-2-12(10)18/h1-6,15,18H/p-1