4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide

Systemtic Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide Openeye Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzamidine CAS Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide IUPAC Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide Traditional Name: 4-[3-(4-amidinophenoxy)-2,2-bis[(4-amidinophenoxy)methyl]propoxy]benzamidine Formula: C33H36N8O4 MolecularWeight: 608.69014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H36N8O4/c34-29(35)21-1-9-25(10-2-21)42-17-33(18-43-26-11-3-22(4-12-26)30(36)37,19-44-27-13-5-23(6-14-27)31(38)39)20-45-28-15-7-24(8-16-28)32(40)41/h1-16H,17-20H2,(H3,34,35)(H3,36,37)(H3,38,39)(H3,40,41)