(4-butyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO6S/c1-4-6-8-18-15-24(27)32-23-16-19(11-14-21(18)23)31-25(28)22(7-5-2)26-33(29,30)20-12-9-17(3)10-13-20/h9-16,22,26H,4-8H2,1-3H3