3-[3-(3-azaniumylpropoxy)-5-methoxycarbonyl-phenoxy]propylazanium dichloride

Systemtic Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonyl-phenoxy]propylazanium dichloride Openeye Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonyl-phenoxy]propylammonium dichloride CAS Name: 3-[3-(3-ammoniopropoxy)-5-methoxycarbonylphenoxy]propylammonium dichloride IUPAC Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonylphenoxy]propylazanium dichloride Traditional Name: 3-[3-(3-ammoniopropoxy)-5-carbomethoxy-phenoxy]propylammonium dichloride Formula: C14H24Cl2N2O4 MolecularWeight: 355.25736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OCCC[NH3+])OCCC[NH3+].[Cl-].[Cl-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OCCC[NH3+])OCCC[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C14H22N2O4.2ClH/c1-18-14(17)11-8-12(19-6-2-4-15)10-13(9-11)20-7-3-5-16;;/h8-10H,2-7,15-16H2,1H3;2*1H