2-[6-(methylamino)-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid

Systemtic Name: 2-[6-(methylamino)-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid Openeye Name: 2-[5-(methylamino)-1-oxo-isoindolin-2-yl]pentanedioic acid CAS Name: 2-[6-(methylamino)-3-oxo-1H-isoindol-2-yl]pentanedioic acid IUPAC Name: 2-[6-(methylamino)-3-oxo-1H-isoindol-2-yl]pentanedioic acid Traditional Name: 2-[1-keto-5-(methylamino)isoindolin-2-yl]glutaric acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)C(=O)N(C2)C(CCC(=O)O)C(=O)O

Isomeric SMILES

CNC1=CC2=C(C=C1)C(=O)N(C2)C(CCC(=O)O)C(=O)O

InChI

InChI=1S/C14H16N2O5/c1-15-9-2-3-10-8(6-9)7-16(13(10)19)11(14(20)21)4-5-12(17)18/h2-3,6,11,15H,4-5,7H2,1H3,(H,17,18)(H,20,21)