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

Systemtic Name: 5-[[2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[2-(4-chloro-2-isopropyl-5-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[2-(4-chloro-2-isopropyl-5-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C21H24ClNO5/c1-12(2)15-9-17(22)13(3)7-19(15)28-11-20(24)23-10-14-5-6-18(27-4)16(8-14)21(25)26/h5-9,12H,10-11H2,1-4H3,(H,23,24)(H,25,26)