3-(3-phenyl-4-piperidin-1-ylcarbonyl-pyrazol-1-yl)propanenitrile

Systemtic Name: 3-(3-phenyl-4-piperidin-1-ylcarbonyl-pyrazol-1-yl)propanenitrile Openeye Name: 3-[3-phenyl-4-(piperidine-1-carbonyl)pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[oxo(1-piperidinyl)methyl]-3-phenyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-phenyl-4-(piperidine-1-carbonyl)pyrazol-1-yl]propanenitrile Traditional Name: 3-[3-phenyl-4-(piperidine-1-carbonyl)pyrazol-1-yl]propionitrile Formula: C18H20N4O MolecularWeight: 308.3776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O/c19-10-7-13-22-14-16(18(23)21-11-5-2-6-12-21)17(20-22)15-8-3-1-4-9-15/h1,3-4,8-9,14H,2,5-7,11-13H2