4-[2-(3,5-dimethylphenoxy)ethylamino]butanoic acid

Systemtic Name: 4-[2-(3,5-dimethylphenoxy)ethylamino]butanoic acid Openeye Name: 4-[2-(3,5-dimethylphenoxy)ethylamino]butanoic acid CAS Name: 4-[2-(3,5-dimethylphenoxy)ethylamino]butanoic acid IUPAC Name: 4-[2-(3,5-dimethylphenoxy)ethylamino]butanoic acid Traditional Name: 4-[2-(3,5-dimethylphenoxy)ethylamino]butyric acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNCCCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNCCCC(=O)O)C

InChI

InChI=1S/C14H21NO3/c1-11-8-12(2)10-13(9-11)18-7-6-15-5-3-4-14(16)17/h8-10,15H,3-7H2,1-2H3,(H,16,17)