(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(butan-2-ylsulfamoyl)benzoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(butan-2-ylsulfamoyl)benzoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 4-(sec-butylsulfamoyl)benzoate CAS Name: 4-(butan-2-ylsulfamoyl)benzoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 4-(butan-2-ylsulfamoyl)benzoate Traditional Name: 4-(sec-butylsulfamoyl)benzoic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C21H20BrNO6S MolecularWeight: 494.3556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C21H20BrNO6S/c1-3-13(2)23-30(26,27)17-7-4-14(5-8-17)21(25)28-12-15-10-20(24)29-19-11-16(22)6-9-18(15)19/h4-11,13,23H,3,12H2,1-2H3