2-[7-(methylamino)-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid

Systemtic Name: 2-[7-(methylamino)-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid Openeye Name: 2-[4-(methylamino)-1-oxo-isoindolin-2-yl]pentanedioic acid CAS Name: 2-[7-(methylamino)-3-oxo-1H-isoindol-2-yl]pentanedioic acid IUPAC Name: 2-[7-(methylamino)-3-oxo-1H-isoindol-2-yl]pentanedioic acid Traditional Name: 2-[1-keto-4-(methylamino)isoindolin-2-yl]glutaric acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC2=C1CN(C2=O)C(CCC(=O)O)C(=O)O

Isomeric SMILES

CNC1=CC=CC2=C1CN(C2=O)C(CCC(=O)O)C(=O)O

InChI

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