3-[3-(4-chlorophenyl)-4-piperidin-1-ylcarbonyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-(4-chlorophenyl)-4-piperidin-1-ylcarbonyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[3-(4-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-1-yl]propanenitrile CAS Name: 3-[3-(4-chlorophenyl)-4-[oxo(1-piperidinyl)methyl]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-(4-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-1-yl]propanenitrile Traditional Name: 3-[3-(4-chlorophenyl)-4-(piperidine-1-carbonyl)pyrazol-1-yl]propionitrile Formula: C18H19ClN4O MolecularWeight: 342.82266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CCC#N

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)CCC#N

InChI

InChI=1S/C18H19ClN4O/c19-15-7-5-14(6-8-15)17-16(13-23(21-17)12-4-9-20)18(24)22-10-2-1-3-11-22/h5-8,13H,1-4,10-12H2