2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-5-carboximidamide dihydrochloride

Systemtic Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-5-carboximidamide dihydrochloride Openeye Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]benzofuran-5-carboxamidine dihydrochloride CAS Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-5-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[3-[6-(4-carbamimidoylphenoxy)hexoxy]phenyl]-1-benzofuran-5-carboximidamide dihydrochloride Traditional Name: 2-[3-[6-(4-amidinophenoxy)hexoxy]phenyl]benzofuran-5-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=CC(=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=CC(=C4)C(=N)N.Cl.Cl

InChI

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