[1-(3,4-dichlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-isobutyl-pyrazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-(2-methylpropyl)-4-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-isobutyl-pyrazol-4-yl]-piperidino-methanone Formula: C21H27Cl2N3O MolecularWeight: 408.36458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC(=C(C=C2)Cl)Cl)CC(C)C)C(=O)N3CCCCC3

Isomeric SMILES

CCC1=C(C(=NN1C2=CC(=C(C=C2)Cl)Cl)CC(C)C)C(=O)N3CCCCC3

InChI

InChI=1S/C21H27Cl2N3O/c1-4-19-20(21(27)25-10-6-5-7-11-25)18(12-14(2)3)24-26(19)15-8-9-16(22)17(23)13-15/h8-9,13-14H,4-7,10-12H2,1-3H3