2-[2,2-dimethylpropoxycarbonyl-[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[2,2-dimethylpropoxycarbonyl-[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonyl-amino]ethanoic acid Openeye Name: 2-[2,2-dimethylpropoxycarbonyl-[6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]amino]acetic acid CAS Name: 2-[[2,2-dimethylpropoxy(oxo)methyl]-[[6-methoxy-5-(trifluoromethyl)-1-naphthalenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[2,2-dimethylpropoxycarbonyl-[6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]amino]acetic acid Traditional Name: 2-[[6-methoxy-5-(trifluoromethyl)-1-naphthoyl]-neopentyloxycarbonyl-amino]acetic acid Formula: C21H22F3NO6 MolecularWeight: 441.39769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC(=O)N(CC(=O)O)C(=O)C1=CC=CC2=C1C=CC(=C2C(F)(F)F)OC

Isomeric SMILES

CC(C)(C)COC(=O)N(CC(=O)O)C(=O)C1=CC=CC2=C1C=CC(=C2C(F)(F)F)OC

InChI

InChI=1S/C21H22F3NO6/c1-20(2,3)11-31-19(29)25(10-16(26)27)18(28)14-7-5-6-13-12(14)8-9-15(30-4)17(13)21(22,23)24/h5-9H,10-11H2,1-4H3,(H,26,27)