2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]acetic acid CAS Name: 2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]acetic acid IUPAC Name: 2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]acetic acid Traditional Name: 2-[4-[bis(cyanomethyl)sulfamoyl]phenoxy]acetic acid Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)O)S(=O)(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)O)S(=O)(=O)N(CC#N)CC#N

InChI

InChI=1S/C12H11N3O5S/c13-5-7-15(8-6-14)21(18,19)11-3-1-10(2-4-11)20-9-12(16)17/h1-4H,7-9H2,(H,16,17)