5-chloranyl-1,2-diphenyl-4-(piperidin-1-ylmethyl)pyrazol-3-one

Systemtic Name: 5-chloranyl-1,2-diphenyl-4-(piperidin-1-ylmethyl)pyrazol-3-one Openeye Name: 5-chloro-1,2-diphenyl-4-(1-piperidylmethyl)pyrazol-3-one CAS Name: 5-chloro-1,2-diphenyl-4-(1-piperidinylmethyl)-3-pyrazolone IUPAC Name: 5-chloro-1,2-diphenyl-4-(piperidin-1-ylmethyl)pyrazol-3-one Traditional Name: 5-chloro-1,2-diphenyl-4-(piperidinomethyl)-3-pyrazolin-3-one Formula: C21H22ClN3O MolecularWeight: 367.87188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3O/c22-20-19(16-23-14-8-3-9-15-23)21(26)25(18-12-6-2-7-13-18)24(20)17-10-4-1-5-11-17/h1-2,4-7,10-13H,3,8-9,14-16H2