[6-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-chromen-2-yl]methyl 2-(trifluoromethyl)benzoate

Systemtic Name: [6-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-chromen-2-yl]methyl 2-(trifluoromethyl)benzoate Openeye Name: [6-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-chromen-2-yl]methyl 2-(trifluoromethyl)benzoate CAS Name: 2-(trifluoromethyl)benzoic acid [6-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-1-benzopyran-2-yl]methyl ester IUPAC Name: [6-[(4-tert-butylphenyl)sulfonylamino]-2-methylchromen-2-yl]methyl 2-(trifluoromethyl)benzoate Traditional Name: 2-(trifluoromethyl)benzoic acid [6-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-chromen-2-yl]methyl ester Formula: C29H28F3NO5S MolecularWeight: 559.59653

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)COC(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC1(C=CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)COC(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C29H28F3NO5S/c1-27(2,3)20-9-12-22(13-10-20)39(35,36)33-21-11-14-25-19(17-21)15-16-28(4,38-25)18-37-26(34)23-7-5-6-8-24(23)29(30,31)32/h5-17,33H,18H2,1-4H3