3-methyl-2-(2-pyridin-4-ylethoxycarbonylamino)butanoic acid

Systemtic Name: 3-methyl-2-(2-pyridin-4-ylethoxycarbonylamino)butanoic acid Openeye Name: 3-methyl-2-[2-(4-pyridyl)ethoxycarbonylamino]butanoic acid CAS Name: 3-methyl-2-[[oxo(2-pyridin-4-ylethoxy)methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-(2-pyridin-4-ylethoxycarbonylamino)butanoic acid Traditional Name: 3-methyl-2-[2-(4-pyridyl)ethoxycarbonylamino]butyric acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)OCCC1=CC=NC=C1

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)OCCC1=CC=NC=C1

InChI

InChI=1S/C13H18N2O4/c1-9(2)11(12(16)17)15-13(18)19-8-5-10-3-6-14-7-4-10/h3-4,6-7,9,11H,5,8H2,1-2H3,(H,15,18)(H,16,17)