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

Systemtic Name: 2-[[2-butyl-6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-butyl-6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]-methyl-amino]acetic acid CAS Name: 2-[[[2-butyl-6-methoxy-5-(trifluoromethyl)-1-naphthalenyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-butyl-6-methoxy-5-(trifluoromethyl)naphthalene-1-carbonyl]-methylamino]acetic acid Traditional Name: 2-[[2-butyl-6-methoxy-5-(trifluoromethyl)-1-naphthoyl]-methyl-amino]acetic acid Formula: C20H22F3NO4 MolecularWeight: 397.38819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C=C1)C(=C(C=C2)OC)C(F)(F)F)C(=O)N(C)CC(=O)O

Isomeric SMILES

CCCCC1=C(C2=C(C=C1)C(=C(C=C2)OC)C(F)(F)F)C(=O)N(C)CC(=O)O

InChI

InChI=1S/C20H22F3NO4/c1-4-5-6-12-7-8-14-13(17(12)19(27)24(2)11-16(25)26)9-10-15(28-3)18(14)20(21,22)23/h7-10H,4-6,11H2,1-3H3,(H,25,26)