(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (3,4,7-trimethyl-2-oxo-chromen-5-yl) 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (3,4,7-trimethyl-2-oxochromen-5-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid (2-keto-3,4,7-trimethyl-chromen-5-yl) ester Formula: C25H29NO6S MolecularWeight: 471.56586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC(=CC3=C2C(=C(C(=O)O3)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC(=CC3=C2C(=C(C(=O)O3)C)C)C

InChI

InChI=1S/C25H29NO6S/c1-14(2)11-20(26-33(29,30)19-9-7-15(3)8-10-19)25(28)32-22-13-16(4)12-21-23(22)17(5)18(6)24(27)31-21/h7-10,12-14,20,26H,11H2,1-6H3