3-[[2-tert-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[2-tert-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-[(2-tert-butyl-1,3-dioxo-isoindoline-5-carbonyl)amino]propanoic acid CAS Name: 3-[[(2-tert-butyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(2-tert-butyl-1,3-dioxoisoindole-5-carbonyl)amino]propanoic acid Traditional Name: 3-[(2-tert-butyl-1,3-diketo-isoindoline-5-carbonyl)amino]propionic acid Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCC(=O)O

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCC(=O)O

InChI

InChI=1S/C16H18N2O5/c1-16(2,3)18-14(22)10-5-4-9(8-11(10)15(18)23)13(21)17-7-6-12(19)20/h4-5,8H,6-7H2,1-3H3,(H,17,21)(H,19,20)