(8-hexyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: (8-hexyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxylic acid (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester IUPAC Name: (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[(tosylamino)methyl]cyclohexanecarboxylic acid (8-hexyl-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) ester Formula: C33H41NO6S MolecularWeight: 579.74674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C4CCC(CC4)CNS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C4CCC(CC4)CNS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C33H41NO6S/c1-3-4-5-6-8-25-19-29-27-9-7-10-28(27)33(36)40-31(29)20-30(25)39-32(35)24-15-13-23(14-16-24)21-34-41(37,38)26-17-11-22(2)12-18-26/h11-12,17-20,23-24,34H,3-10,13-16,21H2,1-2H3