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2-[4-[3-[[2,3-bis(chloranyl)phenyl]carbamoyl-[2-(2-chloranyl-6-fluoranyl-phenyl)ethyl]amino]propyl]phenoxy]-2-methyl-propanoic acid

2-[4-[3-[[2,3-bis(chloranyl)phenyl]carbamoyl-[2-(2-chloranyl-6-fluoranyl-phenyl)ethyl]amino]propyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name:2-[4-[3-[[2,3-bis(chloranyl)phenyl]carbamoyl-[2-(2-chloranyl-6-fluoranyl-phenyl)ethyl]amino]propyl]phenoxy]-2-methyl-propanoic acid
Openeye Name:2-[4-[3-[2-(2-chloro-6-fluoro-phenyl)ethyl-[(2,3-dichlorophenyl)carbamoyl]amino]propyl]phenoxy]-2-methyl-propanoic acid
CAS Name:2-[4-[3-[2-(2-chloro-6-fluorophenyl)ethyl-[(2,3-dichloroanilino)-oxomethyl]amino]propyl]phenoxy]-2-methylpropanoic acid
IUPAC Name:2-[4-[3-[2-(2-chloro-6-fluorophenyl)ethyl-[(2,3-dichlorophenyl)carbamoyl]amino]propyl]phenoxy]-2-methylpropanoic acid
Traditional Name:2-[4-[3-[2-(2-chloro-6-fluoro-phenyl)ethyl-[(2,3-dichlorophenyl)carbamoyl]amino]propyl]phenoxy]-2-methyl-propionic acid
Formula: C28H28Cl3FN2O4
MolecularWeight: 581.890323
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCCN(CCC2=C(C=CC=C2Cl)F)C(=O)NC3=C(C(=CC=C3)Cl)Cl


Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCCN(CCC2=C(C=CC=C2Cl)F)C(=O)NC3=C(C(=CC=C3)Cl)Cl


InChI

InChI=1S/C28H28Cl3FN2O4/c1-28(2,26(35)36)38-19-13-11-18(12-14-19)6-5-16-34(17-15-20-21(29)7-3-9-23(20)32)27(37)33-24-10-4-8-22(30)25(24)31/h3-4,7-14H,5-6,15-17H2,1-2H3,(H,33,37)(H,35,36)


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