5-(4-chlorophenyl)carbonylpyrazine-2-carbonitrile

Systemtic Name: 5-(4-chlorophenyl)carbonylpyrazine-2-carbonitrile Openeye Name: 5-(4-chlorobenzoyl)pyrazine-2-carbonitrile CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-2-pyrazinecarbonitrile IUPAC Name: 5-(4-chlorobenzoyl)pyrazine-2-carbonitrile Traditional Name: 5-(4-chlorobenzoyl)pyrazinonitrile Formula: C12H6ClN3O MolecularWeight: 243.64854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H6ClN3O/c13-9-3-1-8(2-4-9)12(17)11-7-15-10(5-14)6-16-11/h1-4,6-7H