(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-(2-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(2-methyl-N-methylsulfonylanilino)acetic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-(2-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-2-methyl-anilino)acetic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H19NO7S MolecularWeight: 417.43236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)S(=O)(=O)C

InChI

InChI=1S/C20H19NO7S/c1-13-5-3-4-6-17(13)21(29(2,25)26)11-20(24)27-12-14-9-19(23)28-18-10-15(22)7-8-16(14)18/h3-10,22H,11-12H2,1-2H3