2-[[2-(hydroxymethyl)pyrrol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-(hydroxymethyl)pyrrol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(hydroxymethyl)pyrrol-1-yl]methyl]benzonitrile CAS Name: 2-[[2-(hydroxymethyl)-1-pyrrolyl]methyl]benzonitrile IUPAC Name: 2-[[2-(hydroxymethyl)pyrrol-1-yl]methyl]benzonitrile Traditional Name: 2-[(2-methylolpyrrol-1-yl)methyl]benzonitrile Formula: C13H12N2O MolecularWeight: 212.24718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC=C2CO)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC=C2CO)C#N

InChI

InChI=1S/C13H12N2O/c14-8-11-4-1-2-5-12(11)9-15-7-3-6-13(15)10-16/h1-7,16H,9-10H2