4-[(3,5-dimethylphenoxy)carbonylamino]butanoic acid

Systemtic Name: 4-[(3,5-dimethylphenoxy)carbonylamino]butanoic acid Openeye Name: 4-[(3,5-dimethylphenoxy)carbonylamino]butanoic acid CAS Name: 4-[[(3,5-dimethylphenoxy)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(3,5-dimethylphenoxy)carbonylamino]butanoic acid Traditional Name: 4-[(3,5-dimethylphenoxy)carbonylamino]butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)NCCCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)NCCCC(=O)O)C

InChI

InChI=1S/C13H17NO4/c1-9-6-10(2)8-11(7-9)18-13(17)14-5-3-4-12(15)16/h6-8H,3-5H2,1-2H3,(H,14,17)(H,15,16)