2-(1,4-diphenylpyrazol-3-yl)oxy-N,N-diethyl-ethanamine; methanesulfonic acid

Systemtic Name: 2-(1,4-diphenylpyrazol-3-yl)oxy-N,N-diethyl-ethanamine; methanesulfonic acid Openeye Name: 2-(1,4-diphenylpyrazol-3-yl)oxy-N,N-diethyl-ethanamine; methanesulfonic acid CAS Name: 2-[(1,4-diphenyl-3-pyrazolyl)oxy]-N,N-diethylethanamine; methanesulfonic acid IUPAC Name: 2-(1,4-diphenylpyrazol-3-yl)oxy-N,N-diethylethanamine; methanesulfonic acid Traditional Name: 2-(1,4-diphenylpyrazol-3-yl)oxyethyl-diethyl-amine; mesylic acid Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O.CH4O3S/c1-3-23(4-2)15-16-25-21-20(18-11-7-5-8-12-18)17-24(22-21)19-13-9-6-10-14-19;1-5(2,3)4/h5-14,17H,3-4,15-16H2,1-2H3;1H3,(H,2,3,4)