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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CNC(=O)C3=C(C=CC(=C3)COC4=CC=CC=C4C#N)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CNC(=O)C3=C(C=CC(=C3)COC4=CC=CC=C4C#N)CCC(=O)O

InChI

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