(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C26H30ClNO6S MolecularWeight: 520.0375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CCCCCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)CCCCCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H30ClNO6S/c1-3-4-8-19-15-26(30)33-23-17-24(22(27)16-21(19)23)34-25(29)9-6-5-7-14-28-35(31,32)20-12-10-18(2)11-13-20/h10-13,15-17,28H,3-9,14H2,1-2H3