2-[4-[2-[(4-chlorophenyl)-propanoyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(4-chlorophenyl)-propanoyl-amino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-(4-chloro-N-propanoyl-anilino)ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[4-chloro-N-(1-oxopropyl)anilino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-(4-chloro-N-propanoylanilino)ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-(4-chloro-N-propionyl-anilino)ethyl]phenoxy]-2-methyl-propionic acid Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(=O)N(CCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO4/c1-4-19(24)23(17-9-7-16(22)8-10-17)14-13-15-5-11-18(12-6-15)27-21(2,3)20(25)26/h5-12H,4,13-14H2,1-3H3,(H,25,26)