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

Systemtic Name: 3-[4-chloranyl-2-[(ethylazaniumyl)methyl]phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[4-chloro-2-[(ethylammonio)methyl]phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[4-chloro-2-[(ethylammonio)methyl]phenoxy]propyl-dimethylammonium IUPAC Name: 3-[4-chloro-2-[(ethylazaniumyl)methyl]phenoxy]propyl-dimethylazanium Traditional Name: 3-[4-chloro-2-[(ethylammonio)methyl]phenoxy]propyl-dimethyl-ammonium Formula: C14H25ClN2O+2 MolecularWeight: 272.8141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23ClN2O/c1-4-16-11-12-10-13(15)6-7-14(12)18-9-5-8-17(2)3/h6-7,10,16H,4-5,8-9,11H2,1-3H3/p+2