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

Systemtic Name: 2-[[2-bromanyl-6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonyl-propoxycarbonyl-amino]ethanoic acid Openeye Name: 2-[[2-bromo-6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]-propoxycarbonyl-amino]acetic acid CAS Name: 2-[[[2-bromo-6-methoxy-5-(trifluoromethyl)-1-naphthalenyl]-oxomethyl]-[oxo(propoxy)methyl]amino]acetic acid IUPAC Name: 2-[[2-bromo-6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]-propoxycarbonylamino]acetic acid Traditional Name: 2-[[2-bromo-6-methoxy-5-(trifluoromethyl)-1-naphthoyl]-propoxycarbonyl-amino]acetic acid Formula: C19H17BrF3NO6 MolecularWeight: 492.24059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrF3NO6/c1-3-8-30-18(28)24(9-14(25)26)17(27)15-10-5-7-13(29-2)16(19(21,22)23)11(10)4-6-12(15)20/h4-7H,3,8-9H2,1-2H3,(H,25,26)