2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxy-N,N-diethyl-ethanamine; methanesulfonic acid

Systemtic Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxy-N,N-diethyl-ethanamine; methanesulfonic acid Openeye Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxy-N,N-diethyl-ethanamine; methanesulfonic acid CAS Name: 2-[[1-(4-chlorophenyl)-4-phenyl-3-pyrazolyl]oxy]-N,N-diethylethanamine; methanesulfonic acid IUPAC Name: 2-[1-(4-chlorophenyl)-4-phenylpyrazol-3-yl]oxy-N,N-diethylethanamine; methanesulfonic acid Traditional Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]oxyethyl-diethyl-amine; mesylic acid Formula: C22H28ClN3O4S MolecularWeight: 465.99342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=NN(C=C1C2=CC=CC=C2)C3=CC=C(C=C3)Cl.CS(=O)(=O)O

Isomeric SMILES

CCN(CC)CCOC1=NN(C=C1C2=CC=CC=C2)C3=CC=C(C=C3)Cl.CS(=O)(=O)O

InChI

InChI=1S/C21H24ClN3O.CH4O3S/c1-3-24(4-2)14-15-26-21-20(17-8-6-5-7-9-17)16-25(23-21)19-12-10-18(22)11-13-19;1-5(2,3)4/h5-13,16H,3-4,14-15H2,1-2H3;1H3,(H,2,3,4)