2-[4-(2-azaniumylethyl)-2-chloranyl-6-ethoxy-phenoxy]ethyl-dimethyl-azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23ClN2O2/c1-4-18-13-10-11(5-6-16)9-12(15)14(13)19-8-7-17(2)3/h9-10H,4-8,16H2,1-3H3/p+2