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

Systemtic Name: 2-[4-[3-(4-carbamimidoylphenoxy)propoxy]phenyl]-1-benzofuran-5-carboximidamide dihydrochloride Openeye Name: 2-[4-[3-(4-carbamimidoylphenoxy)propoxy]phenyl]benzofuran-5-carboxamidine dihydrochloride CAS Name: 2-[4-[3-(4-carbamimidoylphenoxy)propoxy]phenyl]-5-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[4-[3-(4-carbamimidoylphenoxy)propoxy]phenyl]-1-benzofuran-5-carboximidamide dihydrochloride Traditional Name: 2-[4-[3-(4-amidinophenoxy)propoxy]phenyl]benzofuran-5-carboxamidine dihydrochloride Formula: C25H26Cl2N4O3 MolecularWeight: 501.40494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(O2)C=CC(=C3)C(=N)N)OCCCOC4=CC=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(O2)C=CC(=C3)C(=N)N)OCCCOC4=CC=C(C=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C25H24N4O3.2ClH/c26-24(27)17-4-9-21(10-5-17)31-13-1-12-30-20-7-2-16(3-8-20)23-15-19-14-18(25(28)29)6-11-22(19)32-23;;/h2-11,14-15H,1,12-13H2,(H3,26,27)(H3,28,29);2*1H