N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]acetamide CAS Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]acetamide Formula: C26H37N4O3S+ MolecularWeight: 485.66198

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H36N4O3S/c1-4-30(5-2)34(32,33)24-14-13-22(3)25(20-24)27-26(31)21-29-18-16-28(17-19-29)15-9-12-23-10-7-6-8-11-23/h6-14,20H,4-5,15-19,21H2,1-3H3,(H,27,31)/p+1/b12-9+