[4-(furan-2-ylcarbonylamino)phenyl] 3-methylsulfonylbenzenesulfonate

Systemtic Name: [4-(furan-2-ylcarbonylamino)phenyl] 3-methylsulfonylbenzenesulfonate Openeye Name: [4-(furan-2-carbonylamino)phenyl] 3-methylsulfonylbenzenesulfonate CAS Name: 3-methylsulfonylbenzenesulfonic acid [4-[[2-furanyl(oxo)methyl]amino]phenyl] ester IUPAC Name: [4-(furan-2-carbonylamino)phenyl] 3-methylsulfonylbenzenesulfonate Traditional Name: 3-mesylbenzenesulfonic acid [4-(2-furoylamino)phenyl] ester Formula: C18H15NO7S2 MolecularWeight: 421.4442

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H15NO7S2/c1-27(21,22)15-4-2-5-16(12-15)28(23,24)26-14-9-7-13(8-10-14)19-18(20)17-6-3-11-25-17/h2-12H,1H3,(H,19,20)