(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H22N2O8S MolecularWeight: 474.48368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H22N2O8S/c1-14(25)24-16-3-6-18(7-4-16)33(28,29)23-10-9-21(26)31-13-15-11-22(27)32-20-12-17(30-2)5-8-19(15)20/h3-8,11-12,23H,9-10,13H2,1-2H3,(H,24,25)