6-methoxy-5-[[[4-(trifluoromethyloxy)phenyl]methylamino]methyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-methoxy-5-[[[4-(trifluoromethyloxy)phenyl]methylamino]methyl]naphthalene-2-carboxylic acid Openeye Name: 6-methoxy-5-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]naphthalene-2-carboxylic acid CAS Name: 6-methoxy-5-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-methoxy-5-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]naphthalene-2-carboxylic acid Traditional Name: 6-methoxy-5-[[[4-(trifluoromethoxy)benzyl]amino]methyl]-2-naphthoic acid Formula: C21H18F3NO4 MolecularWeight: 405.36713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(C=C2)C(=O)O)CNCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)C(=O)O)CNCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H18F3NO4/c1-28-19-9-5-14-10-15(20(26)27)4-8-17(14)18(19)12-25-11-13-2-6-16(7-3-13)29-21(22,23)24/h2-10,25H,11-12H2,1H3,(H,26,27)