3-methyl-2-(2-phenoxybutanoylamino)butanoic acid

Systemtic Name: 3-methyl-2-(2-phenoxybutanoylamino)butanoic acid Openeye Name: 3-methyl-2-(2-phenoxybutanoylamino)butanoic acid CAS Name: 3-methyl-2-[(1-oxo-2-phenoxybutyl)amino]butanoic acid IUPAC Name: 3-methyl-2-(2-phenoxybutanoylamino)butanoic acid Traditional Name: 3-methyl-2-(2-phenoxybutanoylamino)butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C(C)C)C(=O)O)OC1=CC=CC=C1

Isomeric SMILES

CCC(C(=O)NC(C(C)C)C(=O)O)OC1=CC=CC=C1

InChI

InChI=1S/C15H21NO4/c1-4-12(20-11-8-6-5-7-9-11)14(17)16-13(10(2)3)15(18)19/h5-10,12-13H,4H2,1-3H3,(H,16,17)(H,18,19)