3-[4-[(3-cyanophenoxy)methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-[(3-cyanophenoxy)methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-[(3-cyanophenoxy)methyl]-2-(1-naphthylmethylcarbamoyl)phenyl]propanoic acid CAS Name: 3-[4-[(3-cyanophenoxy)methyl]-2-[(1-naphthalenylmethylamino)-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(3-cyanophenoxy)methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-[(3-cyanophenoxy)methyl]-2-(1-naphthylmethylcarbamoyl)phenyl]propionic acid Formula: C29H24N2O4 MolecularWeight: 464.51186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CNC(=O)C3=C(C=CC(=C3)COC4=CC=CC(=C4)C#N)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CNC(=O)C3=C(C=CC(=C3)COC4=CC=CC(=C4)C#N)CCC(=O)O

InChI

InChI=1S/C29H24N2O4/c30-17-20-5-3-9-25(15-20)35-19-21-11-12-23(13-14-28(32)33)27(16-21)29(34)31-18-24-8-4-7-22-6-1-2-10-26(22)24/h1-12,15-16H,13-14,18-19H2,(H,31,34)(H,32,33)