5-bromanyl-2-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenecarbonitrile Openeye Name: 5-bromo-2-[[(Z)-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzonitrile CAS Name: 5-bromo-2-[[(Z)-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzonitrile IUPAC Name: 5-bromo-2-[[(Z)-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzonitrile Traditional Name: 5-bromo-2-[[(Z)-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzonitrile Formula: C14H8BrN3O3 MolecularWeight: 346.13562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CNC2=C(C=C(C=C2)Br)C#N)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)/C(=C\NC2=C(C=C(C=C2)Br)C#N)/C=C1[N+](=O)[O-]

InChI

InChI=1S/C14H8BrN3O3/c15-11-1-3-13(9(5-11)7-16)17-8-10-6-12(18(20)21)2-4-14(10)19/h1-6,8,17H/b10-8-