3-bromanyl-4-[6-(2-bromanyl-4-carbamimidoyl-phenoxy)hexoxy]benzenecarboximidamide; 2-oxidanylethanesulfonic acid

Systemtic Name: 3-bromanyl-4-[6-(2-bromanyl-4-carbamimidoyl-phenoxy)hexoxy]benzenecarboximidamide; 2-oxidanylethanesulfonic acid Openeye Name: 3-bromo-4-[6-(2-bromo-4-carbamimidoyl-phenoxy)hexoxy]benzamidine; 2-hydroxyethanesulfonic acid CAS Name: 3-bromo-4-[6-(2-bromo-4-carbamimidoylphenoxy)hexoxy]benzenecarboximidamide; 2-hydroxyethanesulfonic acid IUPAC Name: 3-bromo-4-[6-(2-bromo-4-carbamimidoylphenoxy)hexoxy]benzenecarboximidamide; 2-hydroxyethanesulfonic acid Traditional Name: 4-[6-(4-amidino-2-bromo-phenoxy)hexoxy]-3-bromo-benzamidine; 2-hydroxyethanesulfonic acid Formula: C24H36Br2N4O10S2 MolecularWeight: 764.50144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=N)N)Br)OCCCCCCOC2=C(C=C(C=C2)C(=N)N)Br.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=N)N)Br)OCCCCCCOC2=C(C=C(C=C2)C(=N)N)Br.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O

InChI

InChI=1S/C20H24Br2N4O2.2C2H6O4S/c21-15-11-13(19(23)24)5-7-17(15)27-9-3-1-2-4-10-28-18-8-6-14(20(25)26)12-16(18)22;2*3-1-2-7(4,5)6/h5-8,11-12H,1-4,9-10H2,(H3,23,24)(H3,25,26);2*3H,1-2H2,(H,4,5,6)