2-(2-chloranyl-5-methyl-phenoxy)-2-methyl-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 2-(2-chloranyl-5-methyl-phenoxy)-2-methyl-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 2-(2-chloro-5-methyl-phenoxy)-2-methyl-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 2-(2-chloro-5-methylphenoxy)-2-methyl-1-(4-methyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 2-(2-chloro-5-methylphenoxy)-2-methyl-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 2-(2-chloro-5-methyl-phenoxy)-2-methyl-1-(4-methylpiperazin-4-ium-1-yl)propan-1-one Formula: C16H24ClN2O2+ MolecularWeight: 311.82696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(C)(C)C(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(C)(C)C(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C16H23ClN2O2/c1-12-5-6-13(17)14(11-12)21-16(2,3)15(20)19-9-7-18(4)8-10-19/h5-6,11H,7-10H2,1-4H3/p+1