4-(3-chlorophenyl)carbonyl-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-methyl-pyrrole-2-carbonitrile Openeye Name: 4-(3-chlorobenzoyl)-1-methyl-pyrrole-2-carbonitrile CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 4-(3-chlorobenzoyl)-1-methylpyrrole-2-carbonitrile Traditional Name: 4-(3-chlorobenzoyl)-1-methyl-pyrrole-2-carbonitrile Formula: C13H9ClN2O MolecularWeight: 244.67636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C#N)C(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CN1C=C(C=C1C#N)C(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H9ClN2O/c1-16-8-10(6-12(16)7-15)13(17)9-3-2-4-11(14)5-9/h2-6,8H,1H3