2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenyl-pyrazol-1-ium-1-yl]ethanamide

Systemtic Name: 2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenyl-pyrazol-1-ium-1-yl]ethanamide Openeye Name: 2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenyl-pyrazol-1-ium-1-yl]acetamide CAS Name: 2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenyl-1-pyrazol-1-iumyl]acetamide IUPAC Name: 2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenylpyrazol-1-ium-1-yl]acetamide Traditional Name: 2-[5-[3-(diethylamino)propyl]-1-methyl-3,4-diphenyl-pyrazol-1-ium-1-yl]acetamide Formula: C25H33N4O+ MolecularWeight: 405.55572

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC1=C(C(=N[N+]1(C)CC(=O)N)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCCC1=C(C(=N[N+]1(C)CC(=O)N)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H32N4O/c1-4-28(5-2)18-12-17-22-24(20-13-8-6-9-14-20)25(21-15-10-7-11-16-21)27-29(22,3)19-23(26)30/h6-11,13-16H,4-5,12,17-19H2,1-3H3,(H-,26,30)/p+1