3-[4-[[2-ethyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[[2-ethyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]phenyl]propanoic acid Openeye Name: 3-[4-[(2-ethyl-1,3-dioxo-isoindoline-5-carbonyl)amino]phenyl]propanoic acid CAS Name: 3-[4-[[(2-ethyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-ethyl-1,3-dioxoisoindole-5-carbonyl)amino]phenyl]propanoic acid Traditional Name: 3-[4-[(2-ethyl-1,3-diketo-isoindoline-5-carbonyl)amino]phenyl]propionic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C20H18N2O5/c1-2-22-19(26)15-9-6-13(11-16(15)20(22)27)18(25)21-14-7-3-12(4-8-14)5-10-17(23)24/h3-4,6-9,11H,2,5,10H2,1H3,(H,21,25)(H,23,24)