(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl (2S)-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]propanoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-(tosylamino)propionic 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=C(C=C1)S(=O)(=O)NC(C)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C20H19NO7S/c1-12-3-6-16(7-4-12)29(25,26)21-13(2)20(24)27-11-14-9-19(23)28-18-10-15(22)5-8-17(14)18/h3-10,13,21-22H,11H2,1-2H3/t13-/m0/s1