3-[2-(2,5-dimethylphenoxy)propanoylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[2-(2,5-dimethylphenoxy)propanoylamino]-4-methyl-benzoic acid Openeye Name: 3-[2-(2,5-dimethylphenoxy)propanoylamino]-4-methyl-benzoic acid CAS Name: 3-[[2-(2,5-dimethylphenoxy)-1-oxopropyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[2-(2,5-dimethylphenoxy)propanoylamino]-4-methylbenzoic acid Traditional Name: 3-[2-(2,5-dimethylphenoxy)propanoylamino]-4-methyl-benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-11-5-6-13(3)17(9-11)24-14(4)18(21)20-16-10-15(19(22)23)8-7-12(16)2/h5-10,14H,1-4H3,(H,20,21)(H,22,23)