N-butyl-N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine; methanesulfonic acid

Systemtic Name: N-butyl-N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine; methanesulfonic acid Openeye Name: N-butyl-N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine; methanesulfonic acid CAS Name: N-butyl-N-[2-[(1,4-diphenyl-3-pyrazolyl)oxy]ethyl]-1-butanamine; methanesulfonic acid IUPAC Name: N-butyl-N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine; methanesulfonic acid Traditional Name: dibutyl-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]amine; mesylic acid Formula: C26H37N3O4S MolecularWeight: 487.65468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O.CH4O3S/c1-3-5-17-27(18-6-4-2)19-20-29-25-24(22-13-9-7-10-14-22)21-28(26-25)23-15-11-8-12-16-23;1-5(2,3)4/h7-16,21H,3-6,17-20H2,1-2H3;1H3,(H,2,3,4)