2-[10-(5-carbamimidoyl-1-benzofuran-2-yl)decyl]-1-benzofuran-5-carboximidamide dihydrochloride

Systemtic Name: 2-[10-(5-carbamimidoyl-1-benzofuran-2-yl)decyl]-1-benzofuran-5-carboximidamide dihydrochloride Openeye Name: 2-[10-(5-carbamimidoylbenzofuran-2-yl)decyl]benzofuran-5-carboxamidine dihydrochloride CAS Name: 2-[10-(5-carbamimidoyl-2-benzofuranyl)decyl]-5-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[10-(5-carbamimidoyl-1-benzofuran-2-yl)decyl]-1-benzofuran-5-carboximidamide dihydrochloride Traditional Name: 2-[10-(5-amidinobenzofuran-2-yl)decyl]benzofuran-5-carboxamidine dihydrochloride Formula: C28H36Cl2N4O2 MolecularWeight: 531.51704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=N)N)C=C(O2)CCCCCCCCCCC3=CC4=C(O3)C=CC(=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC2=C(C=C1C(=N)N)C=C(O2)CCCCCCCCCCC3=CC4=C(O3)C=CC(=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C28H34N4O2.2ClH/c29-27(30)19-11-13-25-21(15-19)17-23(33-25)9-7-5-3-1-2-4-6-8-10-24-18-22-16-20(28(31)32)12-14-26(22)34-24;;/h11-18H,1-10H2,(H3,29,30)(H3,31,32);2*1H