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

Systemtic Name: 2-[[6-methoxysulfanyl-5-(trifluoromethyl)naphthalen-1-yl]carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[6-methoxysulfanyl-5-(trifluoromethyl)naphthalene-1-carbonyl]-methyl-amino]acetic acid CAS Name: 2-[[[6-(methoxythio)-5-(trifluoromethyl)-1-naphthalenyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[[6-methoxysulfanyl-5-(trifluoromethyl)naphthalene-1-carbonyl]-methylamino]acetic acid Traditional Name: 2-[[6-(methoxythio)-5-(trifluoromethyl)-1-naphthoyl]-methyl-amino]acetic acid Formula: C16H14F3NO4S MolecularWeight: 373.34687

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC=CC2=C1C=CC(=C2C(F)(F)F)SOC

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC=CC2=C1C=CC(=C2C(F)(F)F)SOC

InChI

InChI=1S/C16H14F3NO4S/c1-20(8-13(21)22)15(23)11-5-3-4-10-9(11)6-7-12(25-24-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)