4-[ethanoyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 4-[ethanoyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid Openeye Name: 4-[acetyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid CAS Name: 4-[acetyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid IUPAC Name: 4-[acetyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid Traditional Name: 4-[acetyl(6,7,8,9-tetrahydrodibenzofuran-2-yl)sulfamoyl]benzoic acid Formula: C21H19NO6S MolecularWeight: 413.44366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC2=C(C=C1)OC3=C2CCCC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(=O)N(C1=CC2=C(C=C1)OC3=C2CCCC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C21H19NO6S/c1-13(23)22(29(26,27)16-9-6-14(7-10-16)21(24)25)15-8-11-20-18(12-15)17-4-2-3-5-19(17)28-20/h6-12H,2-5H2,1H3,(H,24,25)