3-[[2-(2-piperidin-4-ylethyl)-1,3-benzoxazol-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[2-(2-piperidin-4-ylethyl)-1,3-benzoxazol-4-yl]carbonylamino]propanoic acid Openeye Name: 3-[[2-[2-(4-piperidyl)ethyl]-1,3-benzoxazole-4-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[2-[2-(4-piperidinyl)ethyl]-1,3-benzoxazol-4-yl]methyl]amino]propanoic acid IUPAC Name: 3-[[2-(2-piperidin-4-ylethyl)-1,3-benzoxazole-4-carbonyl]amino]propanoic acid Traditional Name: 3-[[2-[2-(4-piperidyl)ethyl]-1,3-benzoxazole-4-carbonyl]amino]propionic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCC2=NC3=C(C=CC=C3O2)C(=O)NCCC(=O)O

Isomeric SMILES

C1CNCCC1CCC2=NC3=C(C=CC=C3O2)C(=O)NCCC(=O)O

InChI

InChI=1S/C18H23N3O4/c22-16(23)8-11-20-18(24)13-2-1-3-14-17(13)21-15(25-14)5-4-12-6-9-19-10-7-12/h1-3,12,19H,4-11H2,(H,20,24)(H,22,23)