(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (7-methyl-2-oxo-4-propyl-chromen-5-yl) 2-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]hexanoic acid (7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-propylchromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-(tosylamino)hexanoic acid (2-keto-7-methyl-4-propyl-chromen-5-yl) ester Formula: C26H31NO6S MolecularWeight: 485.59244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1=CC(=CC2=C1C(=CC(=O)O2)CCC)C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(C(=O)OC1=CC(=CC2=C1C(=CC(=O)O2)CCC)C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H31NO6S/c1-5-7-9-21(27-34(30,31)20-12-10-17(3)11-13-20)26(29)33-23-15-18(4)14-22-25(23)19(8-6-2)16-24(28)32-22/h10-16,21,27H,5-9H2,1-4H3