1-[2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxyethyl]piperidine; methanesulfonic acid

Systemtic Name: 1-[2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxyethyl]piperidine; methanesulfonic acid Openeye Name: 1-[2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxyethyl]piperidine; methanesulfonic acid CAS Name: 1-[2-[[1-(4-chlorophenyl)-4-phenyl-3-pyrazolyl]oxy]ethyl]piperidine; methanesulfonic acid IUPAC Name: 1-[2-[1-(4-chlorophenyl)-4-phenylpyrazol-3-yl]oxyethyl]piperidine; methanesulfonic acid Traditional Name: 1-[2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxyethyl]piperidine; mesylic acid Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1CCN(CC1)CCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)O.C1CCN(CC1)CCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O.CH4O3S/c23-19-9-11-20(12-10-19)26-17-21(18-7-3-1-4-8-18)22(24-26)27-16-15-25-13-5-2-6-14-25;1-5(2,3)4/h1,3-4,7-12,17H,2,5-6,13-16H2;1H3,(H,2,3,4)