2-chloranyl-4-(2-methyl-4-sulfo-phenoxy)benzenesulfonic acid

Systemtic Name: 2-chloranyl-4-(2-methyl-4-sulfo-phenoxy)benzenesulfonic acid Openeye Name: 2-chloro-4-(2-methyl-4-sulfo-phenoxy)benzenesulfonic acid CAS Name: 2-chloro-4-(2-methyl-4-sulfophenoxy)benzenesulfonic acid IUPAC Name: 2-chloro-4-(2-methyl-4-sulfophenoxy)benzenesulfonic acid Traditional Name: 2-chloro-4-(2-methyl-4-sulfo-phenoxy)besylic acid Formula: C13H11ClO7S2 MolecularWeight: 378.80524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)OC2=CC(=C(C=C2)S(=O)(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)OC2=CC(=C(C=C2)S(=O)(=O)O)Cl

InChI

InChI=1S/C13H11ClO7S2/c1-8-6-10(22(15,16)17)3-4-12(8)21-9-2-5-13(11(14)7-9)23(18,19)20/h2-7H,1H3,(H,15,16,17)(H,18,19,20)