(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (8-methyl-2-oxo-4-phenyl-chromen-7-yl) 2-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]hexanoic acid (8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (8-methyl-2-oxo-4-phenylchromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-(tosylamino)hexanoic acid (2-keto-8-methyl-4-phenyl-chromen-7-yl) ester Formula: C29H29NO6S MolecularWeight: 519.60866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1=C(C2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCC(C(=O)OC1=C(C2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H29NO6S/c1-4-5-11-25(30-37(33,34)22-14-12-19(2)13-15-22)29(32)35-26-17-16-23-24(21-9-7-6-8-10-21)18-27(31)36-28(23)20(26)3/h6-10,12-18,25,30H,4-5,11H2,1-3H3