N-(4-bromanyl-2-methyl-phenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C17H24BrN4O3+ MolecularWeight: 412.30146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C17H23BrN4O3/c1-12-9-14(18)3-4-15(12)20-16(24)10-19-17(25)11-21-5-7-22(8-6-21)13(2)23/h3-4,9H,5-8,10-11H2,1-2H3,(H,19,25)(H,20,24)/p+1