(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (6-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(p-tolylsulfonylamino)butanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]butanoic acid (6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-4-methyl-2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 2-(tosylamino)butyric acid (6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C21H20ClNO6S MolecularWeight: 449.9046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C)Cl)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C)Cl)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H20ClNO6S/c1-4-17(23-30(26,27)14-7-5-12(2)6-8-14)21(25)29-19-11-18-15(10-16(19)22)13(3)9-20(24)28-18/h5-11,17,23H,4H2,1-3H3