2-[1-phenyl-2-[tris(bromanyl)methylsulfonyl]benzimidazol-5-yl]ethanoic acid

Systemtic Name: 2-[1-phenyl-2-[tris(bromanyl)methylsulfonyl]benzimidazol-5-yl]ethanoic acid Openeye Name: 2-[1-phenyl-2-(tribromomethylsulfonyl)benzimidazol-5-yl]acetic acid CAS Name: 2-[1-phenyl-2-(tribromomethylsulfonyl)-5-benzimidazolyl]acetic acid IUPAC Name: 2-[1-phenyl-2-(tribromomethylsulfonyl)benzimidazol-5-yl]acetic acid Traditional Name: 2-[1-phenyl-2-(tribromomethylsulfonyl)benzimidazol-5-yl]acetic acid Formula: C16H11Br3N2O4S MolecularWeight: 567.04654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)CC(=O)O)N=C2S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)CC(=O)O)N=C2S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C16H11Br3N2O4S/c17-16(18,19)26(24,25)15-20-12-8-10(9-14(22)23)6-7-13(12)21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H,22,23)