(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-5-sulfamoyl-benzoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-5-sulfamoyl-benzoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 2-methyl-5-sulfamoyl-benzoate CAS Name: 2-methyl-5-sulfamoylbenzoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 2-methyl-5-sulfamoylbenzoate Traditional Name: 2-methyl-5-sulfamoyl-benzoic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H19NO6S MolecularWeight: 401.43296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)C

InChI

InChI=1S/C20H19NO6S/c1-3-13-5-7-16-14(9-19(22)27-18(16)8-13)11-26-20(23)17-10-15(28(21,24)25)6-4-12(17)2/h4-10H,3,11H2,1-2H3,(H2,21,24,25)