[1-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidin-4-yl]-phenyl-methanone

Systemtic Name: [1-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidin-4-yl]-phenyl-methanone Openeye Name: [1-(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)-4-piperidyl]-phenyl-methanone CAS Name: [1-[[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]-4-piperidinyl]-phenylmethanone IUPAC Name: [1-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carbonyl]piperidin-4-yl]-phenylmethanone Traditional Name: [1-(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)-4-piperidyl]-phenyl-methanone Formula: C21H26ClN3O2 MolecularWeight: 387.90304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3)Cl)CC(C)C

InChI

InChI=1S/C21H26ClN3O2/c1-14(2)13-25-20(22)18(15(3)23-25)21(27)24-11-9-17(10-12-24)19(26)16-7-5-4-6-8-16/h4-8,14,17H,9-13H2,1-3H3