ethyl 2-[(4-ethoxy-4-oxidanylidene-butyl)-(4-methylphenyl)sulfonyl-amino]-5-(trifluoromethyloxy)benzoate

Systemtic Name: ethyl 2-[(4-ethoxy-4-oxidanylidene-butyl)-(4-methylphenyl)sulfonyl-amino]-5-(trifluoromethyloxy)benzoate Openeye Name: ethyl 2-[(4-ethoxy-4-oxo-butyl)-(p-tolylsulfonyl)amino]-5-(trifluoromethoxy)benzoate CAS Name: 2-[(4-ethoxy-4-oxobutyl)-(4-methylphenyl)sulfonylamino]-5-(trifluoromethoxy)benzoic acid ethyl ester IUPAC Name: ethyl 2-[(4-ethoxy-4-oxobutyl)-(4-methylphenyl)sulfonylamino]-5-(trifluoromethoxy)benzoate Traditional Name: 2-[(4-ethoxy-4-keto-butyl)-tosyl-amino]-5-(trifluoromethoxy)benzoic acid ethyl ester Formula: C23H26F3NO7S MolecularWeight: 517.51525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(C1=C(C=C(C=C1)OC(F)(F)F)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CCCN(C1=C(C=C(C=C1)OC(F)(F)F)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C23H26F3NO7S/c1-4-32-21(28)7-6-14-27(35(30,31)18-11-8-16(3)9-12-18)20-13-10-17(34-23(24,25)26)15-19(20)22(29)33-5-2/h8-13,15H,4-7,14H2,1-3H3