(7-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (7-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) 2-(p-tolylsulfonylamino)pentanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanoic acid (7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-9-yl) ester IUPAC Name: (7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 2-(tosylamino)valeric acid (4-keto-7-methyl-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) ester Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC(=CC2=C1C3=C(CCC3)C(=O)O2)C)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC(C(=O)OC1=CC(=CC2=C1C3=C(CCC3)C(=O)O2)C)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H27NO6S/c1-4-6-20(26-33(29,30)17-11-9-15(2)10-12-17)25(28)32-22-14-16(3)13-21-23(22)18-7-5-8-19(18)24(27)31-21/h9-14,20,26H,4-8H2,1-3H3