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1-(4-chlorophenyl)-3-ethanoyl-pyrazole-4-carbonitrile

1-(4-chlorophenyl)-3-ethanoyl-pyrazole-4-carbonitrile

Systemtic Name:1-(4-chlorophenyl)-3-ethanoyl-pyrazole-4-carbonitrile
Openeye Name:3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonitrile
CAS Name:3-acetyl-1-(4-chlorophenyl)-4-pyrazolecarbonitrile
IUPAC Name:3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonitrile
Traditional Name:3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonitrile
Formula: C12H8ClN3O
MolecularWeight: 245.66442
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H8ClN3O/c1-8(17)12-9(6-14)7-16(15-12)11-4-2-10(13)3-5-11/h2-5,7H,1H3


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