[3-(4-azanylphenoxy)-2-oxidanyl-propyl]-bis(3-azanylpropyl)-methyl-azanium chloride

Systemtic Name: [3-(4-azanylphenoxy)-2-oxidanyl-propyl]-bis(3-azanylpropyl)-methyl-azanium chloride Openeye Name: [3-(4-aminophenoxy)-2-hydroxy-propyl]-bis(3-aminopropyl)-methyl-ammonium chloride CAS Name: [3-(4-aminophenoxy)-2-hydroxypropyl]-bis(3-aminopropyl)-methylammonium chloride IUPAC Name: [3-(4-aminophenoxy)-2-hydroxypropyl]-bis(3-aminopropyl)-methylazanium chloride Traditional Name: [3-(4-aminophenoxy)-2-hydroxy-propyl]-bis(3-aminopropyl)-methyl-ammonium chloride Formula: C16H31ClN4O2 MolecularWeight: 346.89594

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCN)(CCCN)CC(COC1=CC=C(C=C1)N)O.[Cl-]

Isomeric SMILES

C[N+](CCCN)(CCCN)CC(COC1=CC=C(C=C1)N)O.[Cl-]

InChI

InChI=1S/C16H31N4O2.ClH/c1-20(10-2-8-17,11-3-9-18)12-15(21)13-22-16-6-4-14(19)5-7-16;/h4-7,15,21H,2-3,8-13,17-19H2,1H3;1H/q+1;/p-1