5-azanyl-2-(7-cyano-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-(7-cyano-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-(4-cyano-1-oxo-isoindolin-2-yl)-5-oxo-pentanoic acid CAS Name: 5-amino-2-(7-cyano-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid IUPAC Name: 5-amino-2-(7-cyano-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid Traditional Name: 5-amino-2-(4-cyano-1-keto-isoindolin-2-yl)-5-keto-valeric acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC=C2C(=O)N1C(CCC(=O)N)C(=O)O)C#N

Isomeric SMILES

C1C2=C(C=CC=C2C(=O)N1C(CCC(=O)N)C(=O)O)C#N

InChI

InChI=1S/C14H13N3O4/c15-6-8-2-1-3-9-10(8)7-17(13(9)19)11(14(20)21)4-5-12(16)18/h1-3,11H,4-5,7H2,(H2,16,18)(H,20,21)