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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-12-8-13(2)10-17(9-12)24-14(3)18(21)20-11-15-4-6-16(7-5-15)19(22)23/h4-10,14H,11H2,1-3H3,(H,20,21)(H,22,23)