2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]acetonitrile CAS Name: 2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]acetonitrile Traditional Name: 2-[3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]phenoxy]acetonitrile Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(CCC2)NC3=CC(=CC=C3)OCC#N

Isomeric SMILES

CN1C2=C(C=N1)C(CCC2)NC3=CC(=CC=C3)OCC#N

InChI

InChI=1S/C16H18N4O/c1-20-16-7-3-6-15(14(16)11-18-20)19-12-4-2-5-13(10-12)21-9-8-17/h2,4-5,10-11,15,19H,3,6-7,9H2,1H3