3-[2-(6-methyl-1-benzofuran-3-yl)ethanoylamino]propanoic acid

Systemtic Name: 3-[2-(6-methyl-1-benzofuran-3-yl)ethanoylamino]propanoic acid Openeye Name: 3-[[2-(6-methylbenzofuran-3-yl)acetyl]amino]propanoic acid CAS Name: 3-[[2-(6-methyl-3-benzofuranyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(6-methylbenzofuran-3-yl)acetyl]amino]propionic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NCCC(=O)O

InChI

InChI=1S/C14H15NO4/c1-9-2-3-11-10(8-19-12(11)6-9)7-13(16)15-5-4-14(17)18/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)(H,17,18)