N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide Formula: C23H31ClN3O2+ MolecularWeight: 416.96414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C23H30ClN3O2/c1-16(2)19-7-5-17(3)13-22(19)29-15-23(28)25-18-6-8-21(20(24)14-18)27-11-9-26(4)10-12-27/h5-8,13-14,16H,9-12,15H2,1-4H3,(H,25,28)/p+1