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

Systemtic Name: (5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) 4-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (5-hydroxy-4-oxo-2-phenyl-chromen-7-yl) 4-(p-tolylsulfonylamino)butanoate CAS Name: 4-[(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) 4-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 4-(tosylamino)butyric acid (5-hydroxy-4-keto-2-phenyl-chromen-7-yl) ester Formula: C26H23NO7S MolecularWeight: 493.52832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23NO7S/c1-17-9-11-20(12-10-17)35(31,32)27-13-5-8-25(30)33-19-14-21(28)26-22(29)16-23(34-24(26)15-19)18-6-3-2-4-7-18/h2-4,6-7,9-12,14-16,27-28H,5,8,13H2,1H3