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

Systemtic Name: [1-(2-chlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-(2-chlorophenyl)-5-ethyl-3-isobutyl-pyrazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-(2-chlorophenyl)-5-ethyl-3-(2-methylpropyl)-4-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-(2-chlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(2-chlorophenyl)-5-ethyl-3-isobutyl-pyrazol-4-yl]-piperidino-methanone Formula: C21H28ClN3O MolecularWeight: 373.91952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=CC=C2Cl)CC(C)C)C(=O)N3CCCCC3

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=CC=C2Cl)CC(C)C)C(=O)N3CCCCC3

InChI

InChI=1S/C21H28ClN3O/c1-4-18-20(21(26)24-12-8-5-9-13-24)17(14-15(2)3)23-25(18)19-11-7-6-10-16(19)22/h6-7,10-11,15H,4-5,8-9,12-14H2,1-3H3