2-[5-(4-chlorophenyl)carbonyl-1H-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(4-chlorophenyl)carbonyl-1H-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[5-(4-chlorobenzoyl)-1H-pyrrol-2-yl]acetonitrile CAS Name: 2-[5-[(4-chlorophenyl)-oxomethyl]-1H-pyrrol-2-yl]acetonitrile IUPAC Name: 2-[5-(4-chlorobenzoyl)-1H-pyrrol-2-yl]acetonitrile Traditional Name: 2-[5-(4-chlorobenzoyl)-1H-pyrrol-2-yl]acetonitrile Formula: C13H9ClN2O MolecularWeight: 244.67636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=C(N2)CC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=C(N2)CC#N)Cl

InChI

InChI=1S/C13H9ClN2O/c14-10-3-1-9(2-4-10)13(17)12-6-5-11(16-12)7-8-15/h1-6,16H,7H2