3-[4-(azaniumylmethyl)-2-ethoxy-phenoxy]propyl-dimethyl-azanium

Systemtic Name: 3-[4-(azaniumylmethyl)-2-ethoxy-phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[4-(azaniumylmethyl)-2-ethoxy-phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[4-(ammoniomethyl)-2-ethoxyphenoxy]propyl-dimethylammonium IUPAC Name: 3-[4-(azaniumylmethyl)-2-ethoxyphenoxy]propyl-dimethylazanium Traditional Name: 3-[4-(ammoniomethyl)-2-ethoxy-phenoxy]propyl-dimethyl-ammonium Formula: C14H26N2O2+2 MolecularWeight: 254.36844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2O2/c1-4-17-14-10-12(11-15)6-7-13(14)18-9-5-8-16(2)3/h6-7,10H,4-5,8-9,11,15H2,1-3H3/p+2