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

Systemtic Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonyl-phenoxy]propylazanium Openeye Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonyl-phenoxy]propylammonium CAS Name: 3-[3-(3-ammoniopropoxy)-5-methoxycarbonylphenoxy]propylammonium IUPAC Name: 3-[3-(3-azaniumylpropoxy)-5-methoxycarbonylphenoxy]propylazanium Traditional Name: 3-[3-(3-ammoniopropoxy)-5-carbomethoxy-phenoxy]propylammonium Formula: C14H24N2O4+2 MolecularWeight: 284.35136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O4/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/p+2