2-[1-(4-chlorophenyl)-3-oxidanylidene-3-(1H-pyrrol-2-yl)propyl]propanedinitrile

Systemtic Name: 2-[1-(4-chlorophenyl)-3-oxidanylidene-3-(1H-pyrrol-2-yl)propyl]propanedinitrile Openeye Name: 2-[1-(4-chlorophenyl)-3-oxo-3-(1H-pyrrol-2-yl)propyl]propanedinitrile CAS Name: 2-[1-(4-chlorophenyl)-3-oxo-3-(1H-pyrrol-2-yl)propyl]propanedinitrile IUPAC Name: 2-[1-(4-chlorophenyl)-3-oxo-3-(1H-pyrrol-2-yl)propyl]propanedinitrile Traditional Name: 2-[1-(4-chlorophenyl)-3-keto-3-(1H-pyrrol-2-yl)propyl]malononitrile Formula: C16H12ClN3O MolecularWeight: 297.73898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)CC(C2=CC=C(C=C2)Cl)C(C#N)C#N

Isomeric SMILES

C1=CNC(=C1)C(=O)CC(C2=CC=C(C=C2)Cl)C(C#N)C#N

InChI

InChI=1S/C16H12ClN3O/c17-13-5-3-11(4-6-13)14(12(9-18)10-19)8-16(21)15-2-1-7-20-15/h1-7,12,14,20H,8H2