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

Systemtic Name: (8-hexyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 3-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 3-(4-chlorophenyl)-2-(p-tolylsulfonylamino)propanoate CAS Name: 3-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoic 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) 3-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(4-chlorophenyl)-2-(tosylamino)propionic acid (8-hexyl-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) ester Formula: C34H36ClNO6S MolecularWeight: 622.17074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C(CC4=CC=C(C=C4)Cl)NS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C(CC4=CC=C(C=C4)Cl)NS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C34H36ClNO6S/c1-3-4-5-6-8-24-20-29-27-9-7-10-28(27)33(37)42-32(29)21-31(24)41-34(38)30(19-23-13-15-25(35)16-14-23)36-43(39,40)26-17-11-22(2)12-18-26/h11-18,20-21,30,36H,3-10,19H2,1-2H3