[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (2-oxo-2-ureido-ethyl) 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid (2-keto-2-ureido-ethyl) ester Formula: C14H13N3O6 MolecularWeight: 319.26952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)OCC(=O)NC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C14H13N3O6/c15-14(22)16-10(18)7-23-11(19)5-6-17-12(20)8-3-1-2-4-9(8)13(17)21/h1-4H,5-7H2,(H3,15,16,18,22)