[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(5-methyl-1-phenyl-pyrazol-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(5-methyl-1-phenyl-pyrazol-3-yl)methanone Openeye Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidyl]-(5-methyl-1-phenyl-pyrazol-3-yl)methanone CAS Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-(5-methyl-1-phenyl-3-pyrazolyl)methanone IUPAC Name: [4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-(5-methyl-1-phenylpyrazol-3-yl)methanone Traditional Name: [4-(4-bromophenyl)-4-hydroxy-piperidino]-(5-methyl-1-phenyl-pyrazol-3-yl)methanone Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)(C4=CC=C(C=C4)Br)O

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)(C4=CC=C(C=C4)Br)O

InChI

InChI=1S/C22H22BrN3O2/c1-16-15-20(24-26(16)19-5-3-2-4-6-19)21(27)25-13-11-22(28,12-14-25)17-7-9-18(23)10-8-17/h2-10,15,28H,11-14H2,1H3