4-[2-(1,2-benzoxazol-3-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(1,2-benzoxazol-3-yl)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]butanoic acid CAS Name: 4-[[2-(1,2-benzoxazol-3-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]butanoic acid Traditional Name: 4-[(2-indoxazen-3-ylacetyl)amino]butyric acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)CC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)CC(=O)NCCCC(=O)O

InChI

InChI=1S/C13H14N2O4/c16-12(14-7-3-6-13(17)18)8-10-9-4-1-2-5-11(9)19-15-10/h1-2,4-5H,3,6-8H2,(H,14,16)(H,17,18)