2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]ethanamide Openeye Name: 2-(4-bromo-2-chloro-6-methyl-phenoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]acetamide CAS Name: 2-(4-bromo-2-chloro-6-methylphenoxy)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]acetamide IUPAC Name: 2-(4-bromo-2-chloro-6-methylphenoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]acetamide Traditional Name: 2-(4-bromo-2-chloro-6-methyl-phenoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]acetamide Formula: C19H23BrClN4O2+ MolecularWeight: 454.76852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)Cl)Br

InChI

InChI=1S/C19H22BrClN4O2/c1-13-9-14(20)10-16(21)19(13)27-12-18(26)23-15-3-4-17(22-11-15)25-7-5-24(2)6-8-25/h3-4,9-11H,5-8,12H2,1-2H3,(H,23,26)/p+1