3-[4-[[2,5-bis(chloranyl)phenoxy]methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-[[2,5-bis(chloranyl)phenoxy]methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-[(2,5-dichlorophenoxy)methyl]-2-(1-naphthylmethylcarbamoyl)phenyl]propanoic acid CAS Name: 3-[4-[(2,5-dichlorophenoxy)methyl]-2-[(1-naphthalenylmethylamino)-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2,5-dichlorophenoxy)methyl]-2-(naphthalen-1-ylmethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-[(2,5-dichlorophenoxy)methyl]-2-(1-naphthylmethylcarbamoyl)phenyl]propionic acid Formula: C28H23Cl2NO4 MolecularWeight: 508.39252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H23Cl2NO4/c29-22-11-12-25(30)26(15-22)35-17-18-8-9-20(10-13-27(32)33)24(14-18)28(34)31-16-21-6-3-5-19-4-1-2-7-23(19)21/h1-9,11-12,14-15H,10,13,16-17H2,(H,31,34)(H,32,33)