3-[5-chloranyl-3-ethyl-4-(hydroxymethyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[5-chloranyl-3-ethyl-4-(hydroxymethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[5-chloro-3-ethyl-4-(hydroxymethyl)pyrazol-1-yl]benzonitrile CAS Name: 3-[5-chloro-3-ethyl-4-(hydroxymethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 3-[5-chloro-3-ethyl-4-(hydroxymethyl)pyrazol-1-yl]benzonitrile Traditional Name: 3-(5-chloro-3-ethyl-4-methylol-pyrazol-1-yl)benzonitrile Formula: C13H12ClN3O MolecularWeight: 261.70688

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CO)Cl)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCC1=NN(C(=C1CO)Cl)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H12ClN3O/c1-2-12-11(8-18)13(14)17(16-12)10-5-3-4-9(6-10)7-15/h3-6,18H,2,8H2,1H3