3-[4-chloranyl-2-[(methylazaniumyl)methyl]phenoxy]propyl-dimethyl-azanium

Systemtic Name: 3-[4-chloranyl-2-[(methylazaniumyl)methyl]phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[4-chloro-2-[(methylammonio)methyl]phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[4-chloro-2-[(methylammonio)methyl]phenoxy]propyl-dimethylammonium IUPAC Name: 3-[4-chloro-2-[(methylazaniumyl)methyl]phenoxy]propyl-dimethylazanium Traditional Name: 3-[4-chloro-2-[(methylammonio)methyl]phenoxy]propyl-dimethyl-ammonium Formula: C13H23ClN2O+2 MolecularWeight: 258.78752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1=C(C=CC(=C1)Cl)OCCC[NH+](C)C

Isomeric SMILES

C[NH2+]CC1=C(C=CC(=C1)Cl)OCCC[NH+](C)C

InChI

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