5-[(3-butoxycarbonyl-2-methyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]-2-oxidanyl-benzoate

Systemtic Name: 5-[(3-butoxycarbonyl-2-methyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]-2-oxidanyl-benzoate Openeye Name: 5-[(3-butoxycarbonyl-2-methyl-benzo[g]benzofuran-5-yl)sulfamoyl]-2-hydroxy-benzoate CAS Name: 5-[[3-[butoxy(oxo)methyl]-2-methyl-5-benzo[g]benzofuranyl]sulfamoyl]-2-hydroxybenzoate IUPAC Name: 5-[(3-butoxycarbonyl-2-methylbenzo[g][1]benzofuran-5-yl)sulfamoyl]-2-hydroxybenzoate Traditional Name: 5-[(3-butoxycarbonyl-2-methyl-benzo[g]benzofuran-5-yl)sulfamoyl]-2-hydroxy-benzoate Formula: C25H22NO8S- MolecularWeight: 496.50908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(C=C4)O)C(=O)[O-])C

Isomeric SMILES

CCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(C=C4)O)C(=O)[O-])C

InChI

InChI=1S/C25H23NO8S/c1-3-4-11-33-25(30)22-14(2)34-23-17-8-6-5-7-16(17)20(13-19(22)23)26-35(31,32)15-9-10-21(27)18(12-15)24(28)29/h5-10,12-13,26-27H,3-4,11H2,1-2H3,(H,28,29)/p-1