ethyl 2-[2-(3,4-dimethoxyphenyl)ethyl-(trifluoromethylsulfonyl)amino]-3-methyl-butanoate

Systemtic Name: ethyl 2-[2-(3,4-dimethoxyphenyl)ethyl-(trifluoromethylsulfonyl)amino]-3-methyl-butanoate Openeye Name: ethyl 2-[2-(3,4-dimethoxyphenyl)ethyl-(trifluoromethylsulfonyl)amino]-3-methyl-butanoate CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-(trifluoromethylsulfonyl)amino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[2-(3,4-dimethoxyphenyl)ethyl-(trifluoromethylsulfonyl)amino]-3-methylbutanoate Traditional Name: 2-[homoveratryl(triflyl)amino]-3-methyl-butyric acid ethyl ester Formula: C18H26F3NO6S MolecularWeight: 441.46235

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N(CCC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(C(C)C)N(CCC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C18H26F3NO6S/c1-6-28-17(23)16(12(2)3)22(29(24,25)18(19,20)21)10-9-13-7-8-14(26-4)15(11-13)27-5/h7-8,11-12,16H,6,9-10H2,1-5H3