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

Systemtic Name: 3-[3-[[(2,4-dichlorophenyl)carbonylamino]methyl]-4-propoxy-phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-propoxy-phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[3-[[[(2,4-dichlorophenyl)-oxomethyl]amino]methyl]-4-propoxyphenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-propoxyphenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[[(2,4-dichlorobenzoyl)amino]methyl]-4-propoxy-phenyl]-2-isopropoxy-propionic acid Formula: C23H27Cl2NO5 MolecularWeight: 468.37018

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC(C(=O)O)OC(C)C)CNC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CC(C(=O)O)OC(C)C)CNC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C23H27Cl2NO5/c1-4-9-30-20-8-5-15(11-21(23(28)29)31-14(2)3)10-16(20)13-26-22(27)18-7-6-17(24)12-19(18)25/h5-8,10,12,14,21H,4,9,11,13H2,1-3H3,(H,26,27)(H,28,29)