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

Systemtic Name: 2-[1-[3-(dimethylamino)propyl]-4,5-diphenyl-pyrazol-1-ium-1-yl]ethanamide hydrochloride Openeye Name: 2-[1-[3-(dimethylamino)propyl]-4,5-diphenyl-pyrazol-1-ium-1-yl]acetamide hydrochloride CAS Name: 2-[1-[3-(dimethylamino)propyl]-4,5-diphenyl-1-pyrazol-1-iumyl]acetamide hydrochloride IUPAC Name: 2-[1-[3-(dimethylamino)propyl]-4,5-diphenylpyrazol-1-ium-1-yl]acetamide hydrochloride Traditional Name: 2-[1-[3-(dimethylamino)propyl]-4,5-diphenyl-pyrazol-1-ium-1-yl]acetamide hydrochloride Formula: C22H28ClN4O+ MolecularWeight: 399.93692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC[N+]1(C(=C(C=N1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)N.Cl

Isomeric SMILES

CN(C)CCC[N+]1(C(=C(C=N1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)N.Cl

InChI

InChI=1S/C22H26N4O.ClH/c1-25(2)14-9-15-26(17-21(23)27)22(19-12-7-4-8-13-19)20(16-24-26)18-10-5-3-6-11-18;/h3-8,10-13,16H,9,14-15,17H2,1-2H3,(H-,23,27);1H/p+1