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

Systemtic Name: 2-[2-(2-azaniumylethyl)-4-chloranyl-phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[2-(2-azaniumylethyl)-4-chloro-phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[2-(2-ammonioethyl)-4-chlorophenoxy]ethyl-dimethylammonium IUPAC Name: 2-[2-(2-azaniumylethyl)-4-chlorophenoxy]ethyl-dimethylazanium Traditional Name: 2-[2-(2-ammonioethyl)-4-chloro-phenoxy]ethyl-dimethyl-ammonium Formula: C12H21ClN2O+2 MolecularWeight: 244.76094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19ClN2O/c1-15(2)7-8-16-12-4-3-11(13)9-10(12)5-6-14/h3-4,9H,5-8,14H2,1-2H3/p+2