2-[4-acetamido-4-(4-methylphenyl)piperidin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[4-acetamido-4-(4-methylphenyl)piperidin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[4-acetamido-4-(p-tolyl)piperidin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[4-acetamido-4-(4-methylphenyl)-1-piperidin-1-iumyl]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[4-acetamido-4-(4-methylphenyl)piperidin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[4-acetamido-4-(p-tolyl)piperidin-1-ium-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C22H32N5O2+ MolecularWeight: 398.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC[NH+](CC2)CC(=O)NC3=C(N(N=C3C)C)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(CC[NH+](CC2)CC(=O)NC3=C(N(N=C3C)C)C)NC(=O)C

InChI

InChI=1S/C22H31N5O2/c1-15-6-8-19(9-7-15)22(24-18(4)28)10-12-27(13-11-22)14-20(29)23-21-16(2)25-26(5)17(21)3/h6-9H,10-14H2,1-5H3,(H,23,29)(H,24,28)/p+1