(4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (4-butyl-7-methyl-2-oxo-chromen-5-yl) 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (4-butyl-7-methyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4-butyl-7-methyl-2-oxochromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (4-butyl-2-keto-7-methyl-chromen-5-yl) ester Formula: C24H27NO6S MolecularWeight: 457.53928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H27NO6S/c1-4-5-6-18-15-23(27)31-21-14-17(3)13-20(24(18)21)30-22(26)11-12-25-32(28,29)19-9-7-16(2)8-10-19/h7-10,13-15,25H,4-6,11-12H2,1-3H3