3-[2-cyanoethyl(furan-2-ylmethyl)sulfamoyl]-4-methoxy-benzoate

Systemtic Name: 3-[2-cyanoethyl(furan-2-ylmethyl)sulfamoyl]-4-methoxy-benzoate Openeye Name: 3-[2-cyanoethyl(2-furylmethyl)sulfamoyl]-4-methoxy-benzoate CAS Name: 3-[2-cyanoethyl(2-furanylmethyl)sulfamoyl]-4-methoxybenzoate IUPAC Name: 3-[2-cyanoethyl(furan-2-ylmethyl)sulfamoyl]-4-methoxybenzoate Traditional Name: 3-[2-cyanoethyl(2-furfuryl)sulfamoyl]-4-methoxy-benzoate Formula: C16H15N2O6S- MolecularWeight: 363.3651

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)N(CCC#N)CC2=CC=CO2

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)N(CCC#N)CC2=CC=CO2

InChI

InChI=1S/C16H16N2O6S/c1-23-14-6-5-12(16(19)20)10-15(14)25(21,22)18(8-3-7-17)11-13-4-2-9-24-13/h2,4-6,9-10H,3,8,11H2,1H3,(H,19,20)/p-1