1-[4-(2-chloranyl-4,6-dimethyl-phenoxy)butyl]piperidin-1-ium

Systemtic Name: 1-[4-(2-chloranyl-4,6-dimethyl-phenoxy)butyl]piperidin-1-ium Openeye Name: 1-[4-(2-chloro-4,6-dimethyl-phenoxy)butyl]piperidin-1-ium CAS Name: 1-[4-(2-chloro-4,6-dimethylphenoxy)butyl]piperidin-1-ium IUPAC Name: 1-[4-(2-chloro-4,6-dimethylphenoxy)butyl]piperidin-1-ium Traditional Name: 1-[4-(2-chloro-4,6-dimethyl-phenoxy)butyl]piperidin-1-ium Formula: C17H27ClNO+ MolecularWeight: 296.85538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OCCCC[NH+]2CCCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCCCC[NH+]2CCCCC2)C

InChI

InChI=1S/C17H26ClNO/c1-14-12-15(2)17(16(18)13-14)20-11-7-6-10-19-8-4-3-5-9-19/h12-13H,3-11H2,1-2H3/p+1