1-(3-bromophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile

Systemtic Name: 1-(3-bromophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile Openeye Name: 1-(3-bromophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile CAS Name: 1-(3-bromophenyl)-2,5-dimethyl-3-pyrrolecarbonitrile IUPAC Name: 1-(3-bromophenyl)-2,5-dimethylpyrrole-3-carbonitrile Traditional Name: 1-(3-bromophenyl)-2,5-dimethyl-pyrrole-3-carbonitrile Formula: C13H11BrN2 MolecularWeight: 275.14384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C#N

InChI

InChI=1S/C13H11BrN2/c1-9-6-11(8-15)10(2)16(9)13-5-3-4-12(14)7-13/h3-7H,1-2H3