[cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid

Systemtic Name: [cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid Openeye Name: [cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid CAS Name: [cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid IUPAC Name: [cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid Traditional Name: [cyano-(3-phenoxyphenyl)methoxy]sulfonylmethanesulfonic acid Formula: C15H13NO7S2 MolecularWeight: 383.39622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)OS(=O)(=O)CS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)OS(=O)(=O)CS(=O)(=O)O

InChI

InChI=1S/C15H13NO7S2/c16-10-15(23-25(20,21)11-24(17,18)19)12-5-4-8-14(9-12)22-13-6-2-1-3-7-13/h1-9,15H,11H2,(H,17,18,19)