6-(2-chloranyl-5-methyl-phenoxy)hexyl-diethyl-azanium

Systemtic Name: 6-(2-chloranyl-5-methyl-phenoxy)hexyl-diethyl-azanium Openeye Name: 6-(2-chloro-5-methyl-phenoxy)hexyl-diethyl-ammonium CAS Name: 6-(2-chloro-5-methylphenoxy)hexyl-diethylammonium IUPAC Name: 6-(2-chloro-5-methylphenoxy)hexyl-diethylazanium Traditional Name: 6-(2-chloro-5-methyl-phenoxy)hexyl-diethyl-ammonium Formula: C17H29ClNO+ MolecularWeight: 298.87126

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCCCOC1=C(C=CC(=C1)C)Cl

Isomeric SMILES

CC[NH+](CC)CCCCCCOC1=C(C=CC(=C1)C)Cl

InChI

InChI=1S/C17H28ClNO/c1-4-19(5-2)12-8-6-7-9-13-20-17-14-15(3)10-11-16(17)18/h10-11,14H,4-9,12-13H2,1-3H3/p+1