5-chloranyl-2-methoxy-4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoic acid Openeye Name: 5-chloro-4-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-2-methoxy-4-[[2-(3-methyl-4-propan-2-ylphenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]benzoic acid Traditional Name: 5-chloro-4-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]-2-methoxy-benzoic acid Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)C(C)C

InChI

InChI=1S/C20H22ClNO5/c1-11(2)14-6-5-13(7-12(14)3)27-10-19(23)22-17-9-18(26-4)15(20(24)25)8-16(17)21/h5-9,11H,10H2,1-4H3,(H,22,23)(H,24,25)