cyanomethyl 5-azanyl-4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-oxidanylidene-pentanoate

Systemtic Name: cyanomethyl 5-azanyl-4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-oxidanylidene-pentanoate Openeye Name: cyanomethyl 5-amino-4-(1,3-dioxoisoindolin-2-yl)-5-oxo-pentanoate CAS Name: 5-amino-4-(1,3-dioxo-2-isoindolyl)-5-oxopentanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 5-amino-4-(1,3-dioxoisoindol-2-yl)-5-oxopentanoate Traditional Name: 5-amino-5-keto-4-phthalimido-valeric acid cyanomethyl ester Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O5/c16-7-8-23-12(19)6-5-11(13(17)20)18-14(21)9-3-1-2-4-10(9)15(18)22/h1-4,11H,5-6,8H2,(H2,17,20)