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

Systemtic Name: 2-methoxy-5-[[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylamino]methyl]benzoic acid Openeye Name: 5-[[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 2-methoxy-5-[[[2-(3-methyl-4-propan-2-ylphenoxy)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]methyl]benzoic acid Traditional Name: 5-[[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)C(C)C

InChI

InChI=1S/C21H25NO5/c1-13(2)17-7-6-16(9-14(17)3)27-12-20(23)22-11-15-5-8-19(26-4)18(10-15)21(24)25/h5-10,13H,11-12H2,1-4H3,(H,22,23)(H,24,25)