3-[3-(chloromethyl)-5-methyl-pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-(chloromethyl)-5-methyl-pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[3-(chloromethyl)-5-methyl-pyrazol-1-yl]benzonitrile CAS Name: 3-[3-(chloromethyl)-5-methyl-1-pyrazolyl]benzonitrile IUPAC Name: 3-[3-(chloromethyl)-5-methylpyrazol-1-yl]benzonitrile Traditional Name: 3-[3-(chloromethyl)-5-methyl-pyrazol-1-yl]benzonitrile Formula: C12H10ClN3 MolecularWeight: 231.6809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC(=C2)C#N)CCl

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC(=C2)C#N)CCl

InChI

InChI=1S/C12H10ClN3/c1-9-5-11(7-13)15-16(9)12-4-2-3-10(6-12)8-14/h2-6H,7H2,1H3