N-(4-fluorophenyl)-2-[2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[[2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(4-fluorophenyl)-2-[[2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[[2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(4-fluorophenyl)-2-[[2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Formula: C21H26FN4O2+ MolecularWeight: 385.455143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN4O2/c1-16-4-2-3-5-19(16)26-12-10-25(11-13-26)15-21(28)23-14-20(27)24-18-8-6-17(22)7-9-18/h2-9H,10-15H2,1H3,(H,23,28)(H,24,27)/p+1