3-[3-[[(2,4-dichlorophenyl)carbonylamino]methyl]-4-thiophen-2-yl-phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[[(2,4-dichlorophenyl)carbonylamino]methyl]-4-thiophen-2-yl-phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-(2-thienyl)phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[3-[[[(2,4-dichlorophenyl)-oxomethyl]amino]methyl]-4-thiophen-2-ylphenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-thiophen-2-ylphenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-(2-thienyl)phenyl]-2-isopropoxy-propionic acid Formula: C24H23Cl2NO4S MolecularWeight: 492.41472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC(=C(C=C1)C2=CC=CS2)CNC(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CC(C)OC(CC1=CC(=C(C=C1)C2=CC=CS2)CNC(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C24H23Cl2NO4S/c1-14(2)31-21(24(29)30)11-15-5-7-18(22-4-3-9-32-22)16(10-15)13-27-23(28)19-8-6-17(25)12-20(19)26/h3-10,12,14,21H,11,13H2,1-2H3,(H,27,28)(H,29,30)