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

Systemtic Name: 2-[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Openeye Name: 2-[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride CAS Name: 2-[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]-6-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Traditional Name: 2-[4-[4-(4-amidinophenoxy)butoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride Formula: C26H28Cl2N4O3 MolecularWeight: 515.43152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(O2)C=C(C=C3)C(=N)N)OCCCCOC4=CC=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(O2)C=C(C=C3)C(=N)N)OCCCCOC4=CC=C(C=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C26H26N4O3.2ClH/c27-25(28)18-7-11-22(12-8-18)32-14-2-1-13-31-21-9-5-17(6-10-21)23-15-19-3-4-20(26(29)30)16-24(19)33-23;;/h3-12,15-16H,1-2,13-14H2,(H3,27,28)(H3,29,30);2*1H