2-[2,6-bis(3-chlorophenyl)-4-(6-oxidanylhexylcarbamoyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2,6-bis(3-chlorophenyl)-4-(6-oxidanylhexylcarbamoyl)phenoxy]ethanoic acid Openeye Name: 2-[2,6-bis(3-chlorophenyl)-4-(6-hydroxyhexylcarbamoyl)phenoxy]acetic acid CAS Name: 2-[2,6-bis(3-chlorophenyl)-4-[(6-hydroxyhexylamino)-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[2,6-bis(3-chlorophenyl)-4-(6-hydroxyhexylcarbamoyl)phenoxy]acetic acid Traditional Name: 2-[2,6-bis(3-chlorophenyl)-4-(6-hydroxyhexylcarbamoyl)phenoxy]acetic acid Formula: C27H27Cl2NO5 MolecularWeight: 516.41298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2OCC(=O)O)C3=CC(=CC=C3)Cl)C(=O)NCCCCCCO

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2OCC(=O)O)C3=CC(=CC=C3)Cl)C(=O)NCCCCCCO

InChI

InChI=1S/C27H27Cl2NO5/c28-21-9-5-7-18(13-21)23-15-20(27(34)30-11-3-1-2-4-12-31)16-24(26(23)35-17-25(32)33)19-8-6-10-22(29)14-19/h5-10,13-16,31H,1-4,11-12,17H2,(H,30,34)(H,32,33)