1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid

Systemtic Name: 1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid Openeye Name: 1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid CAS Name: 1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid IUPAC Name: 1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid Traditional Name: 1,2-bis(1H-benzimidazol-2-yl)ethanesulfonic acid Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CC(C3=NC4=CC=CC=C4N3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CC(C3=NC4=CC=CC=C4N3)S(=O)(=O)O

InChI

InChI=1S/C16H14N4O3S/c21-24(22,23)14(16-19-12-7-3-4-8-13(12)20-16)9-15-17-10-5-1-2-6-11(10)18-15/h1-8,14H,9H2,(H,17,18)(H,19,20)(H,21,22,23)