N,N-diethyl-3-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 3-[[2-(4-benzylpiperazin-1-ium-1-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-3-[[1-oxo-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: 3-[[2-(4-benzylpiperazin-1-ium-1-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(4-benzylpiperazin-1-ium-1-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C24H33N4O2+ MolecularWeight: 409.54442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O2/c1-3-28(4-2)24(30)21-11-8-12-22(17-21)25-23(29)19-27-15-13-26(14-16-27)18-20-9-6-5-7-10-20/h5-12,17H,3-4,13-16,18-19H2,1-2H3,(H,25,29)/p+1