N-[1-[5-(4-chlorophenyl)-2,5-dimethyl-4-pyridin-4-yl-1H-pyrazol-2-ium-2-yl]propyl]ethanamide

Systemtic Name: N-[1-[5-(4-chlorophenyl)-2,5-dimethyl-4-pyridin-4-yl-1H-pyrazol-2-ium-2-yl]propyl]ethanamide Openeye Name: N-[1-[5-(4-chlorophenyl)-2,5-dimethyl-4-(4-pyridyl)-1H-pyrazol-2-ium-2-yl]propyl]acetamide CAS Name: N-[1-[5-(4-chlorophenyl)-2,5-dimethyl-4-pyridin-4-yl-1H-pyrazol-2-ium-2-yl]propyl]acetamide IUPAC Name: N-[1-[5-(4-chlorophenyl)-2,5-dimethyl-4-pyridin-4-yl-1H-pyrazol-2-ium-2-yl]propyl]acetamide Traditional Name: N-[1-[3-(4-chlorophenyl)-1,3-dimethyl-4-(4-pyridyl)-3-pyrazolin-1-ium-1-yl]propyl]acetamide Formula: C21H26ClN4O+ MolecularWeight: 385.91034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN4O/c1-5-20(24-15(2)27)26(4)14-19(16-10-12-23-13-11-16)21(3,25-26)17-6-8-18(22)9-7-17/h6-14,20,25H,5H2,1-4H3/p+1