3-[3-azanyl-5-naphthalen-2-yl-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-5-naphthalen-2-yl-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]propanoic acid Openeye Name: 3-[3-amino-5-(2-naphthyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]propanoic acid CAS Name: 3-[3-amino-5-(2-naphthalenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]propanoic acid IUPAC Name: 3-[3-amino-5-naphthalen-2-yl-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]propanoic acid Traditional Name: 3-[3-amino-5-(2-naphthyl)-4-[4-(trifluoromethyl)benzyl]oxy-phenyl]propionic acid Formula: C27H22F3NO3 MolecularWeight: 465.46369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=CC(=CC(=C3OCC4=CC=C(C=C4)C(F)(F)F)N)CCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=CC(=CC(=C3OCC4=CC=C(C=C4)C(F)(F)F)N)CCC(=O)O

InChI

InChI=1S/C27H22F3NO3/c28-27(29,30)22-10-5-17(6-11-22)16-34-26-23(13-18(14-24(26)31)7-12-25(32)33)21-9-8-19-3-1-2-4-20(19)15-21/h1-6,8-11,13-15H,7,12,16,31H2,(H,32,33)