(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) (2R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) (2R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (5-hydroxy-4-oxo-2-phenyl-chromen-7-yl) (2R)-3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid (5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (5-hydroxy-4-oxo-2-phenylchromen-7-yl) (2R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: (2R)-3-methyl-2-(tosylamino)butyric acid (5-hydroxy-4-keto-2-phenyl-chromen-7-yl) ester Formula: C27H25NO7S MolecularWeight: 507.5549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C(C)C)C(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C27H25NO7S/c1-16(2)26(28-36(32,33)20-11-9-17(3)10-12-20)27(31)34-19-13-21(29)25-22(30)15-23(35-24(25)14-19)18-7-5-4-6-8-18/h4-16,26,28-29H,1-3H3/t26-/m1/s1