2-[cyanomethyl-[2-(1-hydroxyethyl)phenyl]amino]ethanenitrile

Systemtic Name: 2-[cyanomethyl-[2-(1-hydroxyethyl)phenyl]amino]ethanenitrile Openeye Name: 2-[N-(cyanomethyl)-2-(1-hydroxyethyl)anilino]acetonitrile CAS Name: 2-[N-(cyanomethyl)-2-(1-hydroxyethyl)anilino]acetonitrile IUPAC Name: 2-[N-(cyanomethyl)-2-(1-hydroxyethyl)anilino]acetonitrile Traditional Name: 2-[N-(cyanomethyl)-2-(1-hydroxyethyl)anilino]acetonitrile Formula: C12H13N3O MolecularWeight: 215.25112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1N(CC#N)CC#N)O

Isomeric SMILES

CC(C1=CC=CC=C1N(CC#N)CC#N)O

InChI

InChI=1S/C12H13N3O/c1-10(16)11-4-2-3-5-12(11)15(8-6-13)9-7-14/h2-5,10,16H,8-9H2,1H3