3-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]propyl-methyl-azanium

Systemtic Name: 3-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]propyl-methyl-azanium Openeye Name: 3-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]propyl-methyl-ammonium CAS Name: 3-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]propyl-methylammonium IUPAC Name: 3-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]propyl-methylazanium Traditional Name: 3-(4-tert-amyl-2-chloro-phenoxy)propyl-methyl-ammonium Formula: C15H25ClNO+ MolecularWeight: 270.8181

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCC[NH2+]C)Cl

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCC[NH2+]C)Cl

InChI

InChI=1S/C15H24ClNO/c1-5-15(2,3)12-7-8-14(13(16)11-12)18-10-6-9-17-4/h7-8,11,17H,5-6,9-10H2,1-4H3/p+1