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

Systemtic Name: 2-[[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-methyl-amino]-2-sulfanylidene-ethanoic acid Openeye Name: 2-[[6-methoxy-5-(trifluoromethyl)-1-naphthyl]-methyl-amino]-2-thioxo-acetic acid CAS Name: 2-[[6-methoxy-5-(trifluoromethyl)-1-naphthalenyl]-methylamino]-2-sulfanylideneacetic acid IUPAC Name: 2-[[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-methylamino]-2-sulfanylideneacetic acid Traditional Name: 2-[[6-methoxy-5-(trifluoromethyl)-1-naphthyl]-methyl-amino]-2-thioxo-acetic acid Formula: C15H12F3NO3S MolecularWeight: 343.32089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12F3NO3S/c1-19(13(23)14(20)21)10-5-3-4-9-8(10)6-7-11(22-2)12(9)15(16,17)18/h3-7H,1-2H3,(H,20,21)