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

Systemtic Name: 4-[2-(3,5-dimethylphenoxy)propanoylamino]benzoic acid Openeye Name: 4-[2-(3,5-dimethylphenoxy)propanoylamino]benzoic acid CAS Name: 4-[[2-(3,5-dimethylphenoxy)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[2-(3,5-dimethylphenoxy)propanoylamino]benzoic acid Traditional Name: 4-[2-(3,5-dimethylphenoxy)propanoylamino]benzoic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO4/c1-11-8-12(2)10-16(9-11)23-13(3)17(20)19-15-6-4-14(5-7-15)18(21)22/h4-10,13H,1-3H3,(H,19,20)(H,21,22)