3-bromanyl-4-[3-(2-bromanyl-4-carbamimidoyl-phenoxy)-2,2-bis[(2-bromanyl-4-carbamimidoyl-phenoxy)methyl]propoxy]benzenecarboximidamide

Systemtic Name: 3-bromanyl-4-[3-(2-bromanyl-4-carbamimidoyl-phenoxy)-2,2-bis[(2-bromanyl-4-carbamimidoyl-phenoxy)methyl]propoxy]benzenecarboximidamide Openeye Name: 3-bromo-4-[3-(2-bromo-4-carbamimidoyl-phenoxy)-2,2-bis[(2-bromo-4-carbamimidoyl-phenoxy)methyl]propoxy]benzamidine CAS Name: 3-bromo-4-[3-(2-bromo-4-carbamimidoylphenoxy)-2,2-bis[(2-bromo-4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide IUPAC Name: 3-bromo-4-[3-(2-bromo-4-carbamimidoylphenoxy)-2,2-bis[(2-bromo-4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide Traditional Name: 4-[3-(4-amidino-2-bromo-phenoxy)-2,2-bis[(4-amidino-2-bromo-phenoxy)methyl]propoxy]-3-bromo-benzamidine Formula: C33H32Br4N8O4 MolecularWeight: 924.27438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=N)N)Br)OCC(COC2=C(C=C(C=C2)C(=N)N)Br)(COC3=C(C=C(C=C3)C(=N)N)Br)COC4=C(C=C(C=C4)C(=N)N)Br

Isomeric SMILES

C1=CC(=C(C=C1C(=N)N)Br)OCC(COC2=C(C=C(C=C2)C(=N)N)Br)(COC3=C(C=C(C=C3)C(=N)N)Br)COC4=C(C=C(C=C4)C(=N)N)Br

InChI

InChI=1S/C33H32Br4N8O4/c34-21-9-17(29(38)39)1-5-25(21)46-13-33(14-47-26-6-2-18(30(40)41)10-22(26)35,15-48-27-7-3-19(31(42)43)11-23(27)36)16-49-28-8-4-20(32(44)45)12-24(28)37/h1-12H,13-16H2,(H3,38,39)(H3,40,41)(H3,42,43)(H3,44,45)