3-[4-(azaniumylmethyl)-2-chloranyl-6-ethoxy-phenoxy]propyl-dimethyl-azanium

Systemtic Name: 3-[4-(azaniumylmethyl)-2-chloranyl-6-ethoxy-phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[4-(azaniumylmethyl)-2-chloro-6-ethoxy-phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[4-(ammoniomethyl)-2-chloro-6-ethoxyphenoxy]propyl-dimethylammonium IUPAC Name: 3-[4-(azaniumylmethyl)-2-chloro-6-ethoxyphenoxy]propyl-dimethylazanium Traditional Name: 3-[4-(ammoniomethyl)-2-chloro-6-ethoxy-phenoxy]propyl-dimethyl-ammonium Formula: C14H25ClN2O2+2 MolecularWeight: 288.8135

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH3+])Cl)OCCC[NH+](C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH3+])Cl)OCCC[NH+](C)C

InChI

InChI=1S/C14H23ClN2O2/c1-4-18-13-9-11(10-16)8-12(15)14(13)19-7-5-6-17(2)3/h8-9H,4-7,10,16H2,1-3H3/p+2