sodium 4-[4-chloranyl-5-(4-chloranylpyridin-3-yl)imidazol-1-yl]benzenesulfonate

Systemtic Name: sodium 4-[4-chloranyl-5-(4-chloranylpyridin-3-yl)imidazol-1-yl]benzenesulfonate Openeye Name: sodium 4-[4-chloro-5-(4-chloro-3-pyridyl)imidazol-1-yl]benzenesulfonate CAS Name: sodium 4-[4-chloro-5-(4-chloro-3-pyridinyl)-1-imidazolyl]benzenesulfonate IUPAC Name: sodium 4-[4-chloro-5-(4-chloropyridin-3-yl)imidazol-1-yl]benzenesulfonate Traditional Name: sodium 4-[4-chloro-5-(4-chloro-3-pyridyl)imidazol-1-yl]besylate Formula: C14H8Cl2N3NaO3S MolecularWeight: 392.19239

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NC(=C2C3=C(C=CN=C3)Cl)Cl)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N2C=NC(=C2C3=C(C=CN=C3)Cl)Cl)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H9Cl2N3O3S.Na/c15-12-5-6-17-7-11(12)13-14(16)18-8-19(13)9-1-3-10(4-2-9)23(20,21)22;/h1-8H,(H,20,21,22);/q;+1/p-1