N-[3,4-bis(4-chlorophenyl)butan-2-yl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)ethanamide

Systemtic Name: N-[3,4-bis(4-chlorophenyl)butan-2-yl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)ethanamide Openeye Name: N-[2,3-bis(4-chlorophenyl)-1-methyl-propyl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)acetamide CAS Name: N-[3,4-bis(4-chlorophenyl)butan-2-yl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)acetamide IUPAC Name: N-[3,4-bis(4-chlorophenyl)butan-2-yl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)acetamide Traditional Name: N-[2,3-bis(4-chlorophenyl)-1-methyl-propyl]-2-(5-methyl-1H-pyrazol-1-ium-1-yl)acetamide Formula: C22H24Cl2N3O+ MolecularWeight: 417.35146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=N[NH+]1CC(=O)NC(C)C(CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=N[NH+]1CC(=O)NC(C)C(CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23Cl2N3O/c1-15-11-12-25-27(15)14-22(28)26-16(2)21(18-5-9-20(24)10-6-18)13-17-3-7-19(23)8-4-17/h3-12,16,21H,13-14H2,1-2H3,(H,26,28)/p+1