2-[1-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[1-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazol-4-yl]ethanenitrile Openeye Name: 2-(1-methyl-3-tetralin-6-yl-pyrazol-4-yl)acetonitrile CAS Name: 2-[1-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-4-pyrazolyl]acetonitrile IUPAC Name: 2-[1-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazol-4-yl]acetonitrile Traditional Name: 2-(1-methyl-3-tetralin-6-yl-pyrazol-4-yl)acetonitrile Formula: C16H17N3 MolecularWeight: 251.32628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(CCCC3)C=C2)CC#N

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(CCCC3)C=C2)CC#N

InChI

InChI=1S/C16H17N3/c1-19-11-15(8-9-17)16(18-19)14-7-6-12-4-2-3-5-13(12)10-14/h6-7,10-11H,2-5,8H2,1H3