5-(3-bromanyl-4-cyano-phenyl)-2-nitro-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-(3-bromanyl-4-cyano-phenyl)-2-nitro-1H-pyrrole-3-carbonitrile Openeye Name: 5-(3-bromo-4-cyano-phenyl)-2-nitro-1H-pyrrole-3-carbonitrile CAS Name: 5-(3-bromo-4-cyanophenyl)-2-nitro-1H-pyrrole-3-carbonitrile IUPAC Name: 5-(3-bromo-4-cyanophenyl)-2-nitro-1H-pyrrole-3-carbonitrile Traditional Name: 5-(3-bromo-4-cyano-phenyl)-2-nitro-1H-pyrrole-3-carbonitrile Formula: C12H5BrN4O2 MolecularWeight: 317.0977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=C(N2)[N+](=O)[O-])C#N)Br)C#N

Isomeric SMILES

C1=CC(=C(C=C1C2=CC(=C(N2)[N+](=O)[O-])C#N)Br)C#N

InChI

InChI=1S/C12H5BrN4O2/c13-10-3-7(1-2-8(10)5-14)11-4-9(6-15)12(16-11)17(18)19/h1-4,16H