2-[4-(2-ethoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-(2-ethoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-(2-ethoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(2-ethoxy-3-pyridinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-(2-ethoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-(2-ethoxynicotinoyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H26N4O3/c1-3-28-20-18(5-4-10-22-20)21(27)25-13-11-24(12-14-25)15-19(26)23-17-8-6-16(2)7-9-17/h4-10H,3,11-15H2,1-2H3,(H,23,26)/p+1