2-[3-(2-diethylaminoethyl)-1,4-diphenyl-pyrazol-1-ium-1-yl]ethanamide

Systemtic Name: 2-[3-(2-diethylaminoethyl)-1,4-diphenyl-pyrazol-1-ium-1-yl]ethanamide Openeye Name: 2-[3-(2-diethylaminoethyl)-1,4-diphenyl-pyrazol-1-ium-1-yl]acetamide CAS Name: 2-[3-(2-diethylaminoethyl)-1,4-diphenyl-1-pyrazol-1-iumyl]acetamide IUPAC Name: 2-[3-(2-diethylaminoethyl)-1,4-diphenylpyrazol-1-ium-1-yl]acetamide Traditional Name: 2-[3-(2-diethylaminoethyl)-1,4-diphenyl-pyrazol-1-ium-1-yl]acetamide Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=N[N+](C=C1C2=CC=CC=C2)(CC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCC1=N[N+](C=C1C2=CC=CC=C2)(CC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O/c1-3-26(4-2)16-15-22-21(19-11-7-5-8-12-19)17-27(25-22,18-23(24)28)20-13-9-6-10-14-20/h5-14,17H,3-4,15-16,18H2,1-2H3,(H-,24,28)/p+1