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

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C22H21ClN2O7S MolecularWeight: 492.92934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)Cl

InChI

InChI=1S/C22H21ClN2O7S/c1-3-14-8-20-18(10-19(14)23)15(9-21(27)32-20)12-31-22(28)11-24-33(29,30)17-6-4-16(5-7-17)25-13(2)26/h4-10,24H,3,11-12H2,1-2H3,(H,25,26)