2-[2-(azaniumylmethyl)-4-chloranyl-phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[2-(azaniumylmethyl)-4-chloranyl-phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[2-(azaniumylmethyl)-4-chloro-phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[2-(ammoniomethyl)-4-chlorophenoxy]ethyl-diethylammonium IUPAC Name: 2-[2-(azaniumylmethyl)-4-chlorophenoxy]ethyl-diethylazanium Traditional Name: 2-[2-(ammoniomethyl)-4-chloro-phenoxy]ethyl-diethyl-ammonium Formula: C13H23ClN2O+2 MolecularWeight: 258.78752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21ClN2O/c1-3-16(4-2)7-8-17-13-6-5-12(14)9-11(13)10-15/h5-6,9H,3-4,7-8,10,15H2,1-2H3/p+2