3-[[3-oxidanylidene-2-[2-(pyridin-2-ylamino)ethyl]-1H-isoindol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-oxidanylidene-2-[2-(pyridin-2-ylamino)ethyl]-1H-isoindol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-[[3-oxo-2-[2-(2-pyridylamino)ethyl]isoindoline-5-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[3-oxo-2-[2-(2-pyridinylamino)ethyl]-1H-isoindol-5-yl]methyl]amino]propanoic acid IUPAC Name: 3-[[3-oxo-2-[2-(pyridin-2-ylamino)ethyl]-1H-isoindole-5-carbonyl]amino]propanoic acid Traditional Name: 3-[[3-keto-2-[2-(2-pyridylamino)ethyl]isoindoline-5-carbonyl]amino]propionic acid Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)NCCC(=O)O)C(=O)N1CCNC3=CC=CC=N3

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)NCCC(=O)O)C(=O)N1CCNC3=CC=CC=N3

InChI

InChI=1S/C19H20N4O4/c24-17(25)6-8-22-18(26)13-4-5-14-12-23(19(27)15(14)11-13)10-9-21-16-3-1-2-7-20-16/h1-5,7,11H,6,8-10,12H2,(H,20,21)(H,22,26)(H,24,25)