2-[3-[(1-methylpyrazol-4-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(1-methylpyrazol-4-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(1-methylpyrazol-4-yl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(1-methyl-4-pyrazolyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(1-methylpyrazol-4-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(1-methylpyrazol-4-yl)methylamino]phenoxy]acetonitrile Formula: C13H14N4O MolecularWeight: 242.27646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CN1C=C(C=N1)CNC2=CC(=CC=C2)OCC#N

InChI

InChI=1S/C13H14N4O/c1-17-10-11(9-16-17)8-15-12-3-2-4-13(7-12)18-6-5-14/h2-4,7,9-10,15H,6,8H2,1H3