(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (5-hydroxy-4-oxo-2-phenyl-chromen-7-yl) 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid (5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (5-hydroxy-4-oxo-2-phenylchromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid (5-hydroxy-4-keto-2-phenyl-chromen-7-yl) ester Formula: C28H27NO7S MolecularWeight: 521.58148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27NO7S/c1-19-11-13-22(14-12-19)37(33,34)29-15-7-3-6-10-27(32)35-21-16-23(30)28-24(31)18-25(36-26(28)17-21)20-8-4-2-5-9-20/h2,4-5,8-9,11-14,16-18,29-30H,3,6-7,10,15H2,1H3