3-[3-(4-methylphenyl)-4-morpholin-4-ylcarbonyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-(4-methylphenyl)-4-morpholin-4-ylcarbonyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-(morpholine-4-carbonyl)-3-(p-tolyl)pyrazol-1-yl]propanenitrile CAS Name: 3-[3-(4-methylphenyl)-4-[4-morpholinyl(oxo)methyl]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-(4-methylphenyl)-4-(morpholine-4-carbonyl)pyrazol-1-yl]propanenitrile Traditional Name: 3-[4-(morpholine-4-carbonyl)-3-(p-tolyl)pyrazol-1-yl]propionitrile Formula: C18H20N4O2 MolecularWeight: 324.377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCOCC3)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCOCC3)CCC#N

InChI

InChI=1S/C18H20N4O2/c1-14-3-5-15(6-4-14)17-16(13-22(20-17)8-2-7-19)18(23)21-9-11-24-12-10-21/h3-6,13H,2,8-12H2,1H3