2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[2-(2-thienyl)ethyl]acetamide Formula: C21H28N3OS+ MolecularWeight: 370.53152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CS2)CC=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CS2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H27N3OS/c25-21(22-11-10-20-9-5-17-26-20)18-24-15-13-23(14-16-24)12-4-8-19-6-2-1-3-7-19/h1-9,17H,10-16,18H2,(H,22,25)/p+1/b8-4+