4-[[3-(hydroxymethyl)pyrazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-(hydroxymethyl)pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[3-(hydroxymethyl)pyrazol-1-yl]methyl]benzonitrile CAS Name: 4-[[3-(hydroxymethyl)-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 4-[[3-(hydroxymethyl)pyrazol-1-yl]methyl]benzonitrile Traditional Name: 4-[(3-methylolpyrazol-1-yl)methyl]benzonitrile Formula: C12H11N3O MolecularWeight: 213.23524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=N2)CO)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=N2)CO)C#N

InChI

InChI=1S/C12H11N3O/c13-7-10-1-3-11(4-2-10)8-15-6-5-12(9-16)14-15/h1-6,16H,8-9H2