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

Systemtic Name: 3-[4-(azaniumylmethyl)-2-methoxy-phenoxy]propyl-dimethyl-azanium Openeye Name: 3-[4-(azaniumylmethyl)-2-methoxy-phenoxy]propyl-dimethyl-ammonium CAS Name: 3-[4-(ammoniomethyl)-2-methoxyphenoxy]propyl-dimethylammonium IUPAC Name: 3-[4-(azaniumylmethyl)-2-methoxyphenoxy]propyl-dimethylazanium Traditional Name: 3-[4-(ammoniomethyl)-2-methoxy-phenoxy]propyl-dimethyl-ammonium Formula: C13H24N2O2+2 MolecularWeight: 240.34186

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=C(C=C(C=C1)C[NH3+])OC

Isomeric SMILES

C[NH+](C)CCCOC1=C(C=C(C=C1)C[NH3+])OC

InChI

InChI=1S/C13H22N2O2/c1-15(2)7-4-8-17-12-6-5-11(10-14)9-13(12)16-3/h5-6,9H,4,7-8,10,14H2,1-3H3/p+2