2-[4-[5-(4-chlorophenyl)furan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[5-(4-chlorophenyl)furan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[5-(4-chlorophenyl)furan-2-carbonyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[[5-(4-chlorophenyl)-2-furanyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[5-(4-chlorophenyl)furan-2-carbonyl]piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[5-(4-chlorophenyl)-2-furoyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C24H25ClN3O3+ MolecularWeight: 438.9266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H24ClN3O3/c1-17-2-8-20(9-3-17)26-23(29)16-27-12-14-28(15-13-27)24(30)22-11-10-21(31-22)18-4-6-19(25)7-5-18/h2-11H,12-16H2,1H3,(H,26,29)/p+1