2-isocyano-2-[3-[oxidanyl(pyridin-4-yl)methyl]phenyl]ethanenitrile

Systemtic Name: 2-isocyano-2-[3-[oxidanyl(pyridin-4-yl)methyl]phenyl]ethanenitrile Openeye Name: 2-[3-[hydroxy(4-pyridyl)methyl]phenyl]-2-isocyano-acetonitrile CAS Name: 2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]-2-isocyanoacetonitrile IUPAC Name: 2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]-2-isocyanoacetonitrile Traditional Name: 2-[3-[hydroxy(4-pyridyl)methyl]phenyl]-2-isocyano-acetonitrile Formula: C15H11N3O MolecularWeight: 249.26734

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C(C#N)C1=CC(=CC=C1)C(C2=CC=NC=C2)O

Isomeric SMILES

[C-]#[N+]C(C#N)C1=CC(=CC=C1)C(C2=CC=NC=C2)O

InChI

InChI=1S/C15H11N3O/c1-17-14(10-16)12-3-2-4-13(9-12)15(19)11-5-7-18-8-6-11/h2-9,14-15,19H