3-[4-(hydroxymethyl)piperidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(hydroxymethyl)piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(hydroxymethyl)piperidine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(hydroxymethyl)-1-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(hydroxymethyl)piperidine-1-carbonyl]benzonitrile Traditional Name: 3-(4-methylolpiperidine-1-carbonyl)benzonitrile Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)C(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(CCC1CO)C(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H16N2O2/c15-9-12-2-1-3-13(8-12)14(18)16-6-4-11(10-17)5-7-16/h1-3,8,11,17H,4-7,10H2