sodium 4-(4-chloranyl-5-phenyl-imidazol-1-yl)benzenesulfonate

Systemtic Name: sodium 4-(4-chloranyl-5-phenyl-imidazol-1-yl)benzenesulfonate Openeye Name: sodium 4-(4-chloro-5-phenyl-imidazol-1-yl)benzenesulfonate CAS Name: sodium 4-(4-chloro-5-phenyl-1-imidazolyl)benzenesulfonate IUPAC Name: sodium 4-(4-chloro-5-phenylimidazol-1-yl)benzenesulfonate Traditional Name: sodium 4-(4-chloro-5-phenyl-imidazol-1-yl)besylate Formula: C15H10ClN2NaO3S MolecularWeight: 356.75927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=CN2C3=CC=C(C=C3)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=CN2C3=CC=C(C=C3)S(=O)(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C15H11ClN2O3S.Na/c16-15-14(11-4-2-1-3-5-11)18(10-17-15)12-6-8-13(9-7-12)22(19,20)21;/h1-10H,(H,19,20,21);/q;+1/p-1