2-[4-[(E)-but-2-enoyl]piperazin-1-ium-1-yl]-N-(2-chlorophenyl)ethanamide

Systemtic Name: 2-[4-[(E)-but-2-enoyl]piperazin-1-ium-1-yl]-N-(2-chlorophenyl)ethanamide Openeye Name: 2-[4-[(E)-but-2-enoyl]piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[(E)-1-oxobut-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-[(E)-but-2-enoyl]piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[4-[(E)-but-2-enoyl]piperazin-1-ium-1-yl]-N-(2-chlorophenyl)acetamide Formula: C16H21ClN3O2+ MolecularWeight: 322.80984

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

C/C=C/C(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C16H20ClN3O2/c1-2-5-16(22)20-10-8-19(9-11-20)12-15(21)18-14-7-4-3-6-13(14)17/h2-7H,8-12H2,1H3,(H,18,21)/p+1/b5-2+