1-[2-(4-bromanylphenoxy)ethyl]benzimidazole-2-sulfonate

Systemtic Name: 1-[2-(4-bromanylphenoxy)ethyl]benzimidazole-2-sulfonate Openeye Name: 1-[2-(4-bromophenoxy)ethyl]benzimidazole-2-sulfonate CAS Name: 1-[2-(4-bromophenoxy)ethyl]-2-benzimidazolesulfonate IUPAC Name: 1-[2-(4-bromophenoxy)ethyl]benzimidazole-2-sulfonate Traditional Name: 1-[2-(4-bromophenoxy)ethyl]benzimidazole-2-sulfonate Formula: C15H12BrN2O4S- MolecularWeight: 396.23578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCOC3=CC=C(C=C3)Br)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCOC3=CC=C(C=C3)Br)S(=O)(=O)[O-]

InChI

InChI=1S/C15H13BrN2O4S/c16-11-5-7-12(8-6-11)22-10-9-18-14-4-2-1-3-13(14)17-15(18)23(19,20)21/h1-8H,9-10H2,(H,19,20,21)/p-1