2-dimethylaminoethyl 2-butyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]carbonyl-1-benzofuran-5-carboxylate

Systemtic Name: 2-dimethylaminoethyl 2-butyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]carbonyl-1-benzofuran-5-carboxylate Openeye Name: 2-dimethylaminoethyl 2-butyl-3-[4-(trifluoromethylsulfonyloxy)benzoyl]benzofuran-5-carboxylate CAS Name: 2-butyl-3-[oxo-[4-(trifluoromethylsulfonyloxy)phenyl]methyl]-5-benzofurancarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 2-butyl-3-[4-(trifluoromethylsulfonyloxy)benzoyl]-1-benzofuran-5-carboxylate Traditional Name: 2-butyl-3-(4-triflyloxybenzoyl)benzofuran-5-carboxylic acid 2-dimethylaminoethyl ester Formula: C25H26F3NO7S MolecularWeight: 541.53665

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OCCN(C)C)C(=O)C3=CC=C(C=C3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OCCN(C)C)C(=O)C3=CC=C(C=C3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C25H26F3NO7S/c1-4-5-6-21-22(19-15-17(9-12-20(19)35-21)24(31)34-14-13-29(2)3)23(30)16-7-10-18(11-8-16)36-37(32,33)25(26,27)28/h7-12,15H,4-6,13-14H2,1-3H3