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

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 2-phenyl-2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetate Traditional Name: 2-phenyl-2-(tosylamino)acetic acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C28H26ClNO6S MolecularWeight: 540.02714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H26ClNO6S/c1-3-4-8-20-15-26(31)35-24-17-25(23(29)16-22(20)24)36-28(32)27(19-9-6-5-7-10-19)30-37(33,34)21-13-11-18(2)12-14-21/h5-7,9-17,27,30H,3-4,8H2,1-2H3