2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride

Systemtic Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Openeye Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride CAS Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-6-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Traditional Name: 2-[3-[6-(4-amidinophenoxy)hexoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride Formula: C28H32Cl2N4O3 MolecularWeight: 543.48468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCCOC2=CC=C(C=C2)C(=N)N)C3=CC4=C(O3)C=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCCOC2=CC=C(C=C2)C(=N)N)C3=CC4=C(O3)C=C(C=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C28H30N4O3.2ClH/c29-27(30)19-10-12-23(13-11-19)33-14-3-1-2-4-15-34-24-7-5-6-20(16-24)25-17-21-8-9-22(28(31)32)18-26(21)35-25;;/h5-13,16-18H,1-4,14-15H2,(H3,29,30)(H3,31,32);2*1H