N-(2-chlorophenyl)-2-[4-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-acetyl-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide CAS Name: 2-[4-[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-chlorophenyl)acetamide IUPAC Name: 2-[4-(4-acetyl-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[4-(4-acetyl-1H-pyrrole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Formula: C19H22ClN4O3+ MolecularWeight: 389.85598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C19H21ClN4O3/c1-13(25)14-10-17(21-11-14)19(27)24-8-6-23(7-9-24)12-18(26)22-16-5-3-2-4-15(16)20/h2-5,10-11,21H,6-9,12H2,1H3,(H,22,26)/p+1