(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H19ClN2O7S MolecularWeight: 478.90276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)Cl

InChI

InChI=1S/C21H19ClN2O7S/c1-12-7-19-17(9-18(12)22)14(8-20(26)31-19)11-30-21(27)10-23-32(28,29)16-5-3-15(4-6-16)24-13(2)25/h3-9,23H,10-11H2,1-2H3,(H,24,25)