3-[[3-oxidanylidene-2-(2-piperidin-4-ylethyl)-1H-isoindol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-oxidanylidene-2-(2-piperidin-4-ylethyl)-1H-isoindol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-[[3-oxo-2-[2-(4-piperidyl)ethyl]isoindoline-5-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[3-oxo-2-[2-(4-piperidinyl)ethyl]-1H-isoindol-5-yl]methyl]amino]propanoic acid IUPAC Name: 3-[[3-oxo-2-(2-piperidin-4-ylethyl)-1H-isoindole-5-carbonyl]amino]propanoic acid Traditional Name: 3-[[3-keto-2-[2-(4-piperidyl)ethyl]isoindoline-5-carbonyl]amino]propionic acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCN2CC3=C(C2=O)C=C(C=C3)C(=O)NCCC(=O)O

Isomeric SMILES

C1CNCCC1CCN2CC3=C(C2=O)C=C(C=C3)C(=O)NCCC(=O)O

InChI

InChI=1S/C19H25N3O4/c23-17(24)5-9-21-18(25)14-1-2-15-12-22(19(26)16(15)11-14)10-6-13-3-7-20-8-4-13/h1-2,11,13,20H,3-10,12H2,(H,21,25)(H,23,24)