2-(azocan-1-ium-1-yl)-N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]acetamide Formula: C19H26ClN4O+ MolecularWeight: 361.88894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)NC(=O)C[NH+]3CCCCCCC3

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)NC(=O)C[NH+]3CCCCCCC3

InChI

InChI=1S/C19H25ClN4O/c1-23-18(13-17(22-23)15-7-9-16(20)10-8-15)21-19(25)14-24-11-5-3-2-4-6-12-24/h7-10,13H,2-6,11-12,14H2,1H3,(H,21,25)/p+1