3-[4-[[(2-methylphenyl)amino]methyl]-2-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid

Systemtic Name: 3-[4-[[(2-methylphenyl)amino]methyl]-2-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid Openeye Name: 3-[4-[(2-methylanilino)methyl]-2-[2-(2-naphthyl)ethoxy]phenyl]propanoic acid CAS Name: 3-[4-[(2-methylanilino)methyl]-2-[2-(2-naphthalenyl)ethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-methylanilino)methyl]-2-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid Traditional Name: 3-[2-[2-(2-naphthyl)ethoxy]-4-(o-toluidinomethyl)phenyl]propionic acid Formula: C29H29NO3 MolecularWeight: 439.54546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NCC2=CC(=C(C=C2)CCC(=O)O)OCCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CC=C1NCC2=CC(=C(C=C2)CCC(=O)O)OCCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H29NO3/c1-21-6-2-5-9-27(21)30-20-23-11-13-25(14-15-29(31)32)28(19-23)33-17-16-22-10-12-24-7-3-4-8-26(24)18-22/h2-13,18-19,30H,14-17,20H2,1H3,(H,31,32)