3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxo-propanenitrile CAS Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-3-oxopropanenitrile IUPAC Name: 3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-3-oxopropanenitrile Traditional Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-3-keto-propionitrile Formula: C15H13BrN2O MolecularWeight: 317.18052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13BrN2O/c1-10-9-14(15(19)7-8-17)11(2)18(10)13-5-3-12(16)4-6-13/h3-6,9H,7H2,1-2H3