N-methyl-3-[2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-methyl-3-[2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanoylamino]benzamide Openeye Name: 3-[[2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-methyl-benzamide CAS Name: N-methyl-3-[[1-oxo-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]ethyl]amino]benzamide IUPAC Name: N-methyl-3-[[2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]acetyl]amino]benzamide Traditional Name: 3-[[2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-methyl-benzamide Formula: C23H30N4O2+2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2/c1-24-23(29)20-10-5-11-21(17-20)25-22(28)18-27-15-13-26(14-16-27)12-6-9-19-7-3-2-4-8-19/h2-11,17H,12-16,18H2,1H3,(H,24,29)(H,25,28)/p+2/b9-6+