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

Systemtic Name: 4-(2-bromanyl-4-methyl-phenyl)-5-nitro-1H-pyrrole-2-carbonitrile Openeye Name: 4-(2-bromo-4-methyl-phenyl)-5-nitro-1H-pyrrole-2-carbonitrile CAS Name: 4-(2-bromo-4-methylphenyl)-5-nitro-1H-pyrrole-2-carbonitrile IUPAC Name: 4-(2-bromo-4-methylphenyl)-5-nitro-1H-pyrrole-2-carbonitrile Traditional Name: 4-(2-bromo-4-methyl-phenyl)-5-nitro-1H-pyrrole-2-carbonitrile Formula: C12H8BrN3O2 MolecularWeight: 306.11482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(NC(=C2)C#N)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(NC(=C2)C#N)[N+](=O)[O-])Br

InChI

InChI=1S/C12H8BrN3O2/c1-7-2-3-9(11(13)4-7)10-5-8(6-14)15-12(10)16(17)18/h2-5,15H,1H3