4-(4-chloranyl-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-(4-methyl-1-piperazin-4-iumyl)butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-(4-methylpiperazin-4-ium-1-yl)butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)butyramide Formula: C16H25ClN3O2+ MolecularWeight: 326.8416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NN2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NN2CC[NH+](CC2)C

InChI

InChI=1S/C16H24ClN3O2/c1-13-12-14(17)5-6-15(13)22-11-3-4-16(21)18-20-9-7-19(2)8-10-20/h5-6,12H,3-4,7-11H2,1-2H3,(H,18,21)/p+1