3-(5-chloranyl-4-methanoyl-3-methyl-pyrazol-1-yl)benzenecarbonitrile

Systemtic Name: 3-(5-chloranyl-4-methanoyl-3-methyl-pyrazol-1-yl)benzenecarbonitrile Openeye Name: 3-(5-chloro-4-formyl-3-methyl-pyrazol-1-yl)benzonitrile CAS Name: 3-(5-chloro-4-formyl-3-methyl-1-pyrazolyl)benzonitrile IUPAC Name: 3-(5-chloro-4-formyl-3-methylpyrazol-1-yl)benzonitrile Traditional Name: 3-(5-chloro-4-formyl-3-methyl-pyrazol-1-yl)benzonitrile Formula: C12H8ClN3O MolecularWeight: 245.66442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)Cl)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=NN(C(=C1C=O)Cl)C2=CC=CC(=C2)C#N

InChI

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