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4-[3-[4-(3-azanylpropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride

4-[3-[4-(3-azanylpropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride

Systemtic Name:4-[3-[4-(3-azanylpropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride
Openeye Name:4-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride
CAS Name:4-[[3-[4-(3-aminopropylamino)butylamino]propylamino]-oxomethyl]benzoic acid trihydrochloride
IUPAC Name:4-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride
Traditional Name:4-[3-[4-(3-aminopropylamino)butylamino]propylcarbamoyl]benzoic acid trihydrochloride
Formula: C18H33Cl3N4O3
MolecularWeight: 459.83862
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCNCCCCNCCCN)C(=O)O.Cl.Cl.Cl


Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCNCCCCNCCCN)C(=O)O.Cl.Cl.Cl


InChI

InChI=1S/C18H30N4O3.3ClH/c19-9-3-12-20-10-1-2-11-21-13-4-14-22-17(23)15-5-7-16(8-6-15)18(24)25;;;/h5-8,20-21H,1-4,9-14,19H2,(H,22,23)(H,24,25);3*1H


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