2-[4-(methylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]butanedioic acid

Systemtic Name: 2-[4-(methylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]butanedioic acid Openeye Name: 2-[4-(methylamino)-1,3-dioxo-isoindolin-2-yl]butanedioic acid CAS Name: 2-[4-(methylamino)-1,3-dioxo-2-isoindolyl]butanedioic acid IUPAC Name: 2-[4-(methylamino)-1,3-dioxoisoindol-2-yl]butanedioic acid Traditional Name: 2-[1,3-diketo-4-(methylamino)isoindolin-2-yl]succinic acid Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC2=C1C(=O)N(C2=O)C(CC(=O)O)C(=O)O

Isomeric SMILES

CNC1=CC=CC2=C1C(=O)N(C2=O)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C13H12N2O6/c1-14-7-4-2-3-6-10(7)12(19)15(11(6)18)8(13(20)21)5-9(16)17/h2-4,8,14H,5H2,1H3,(H,16,17)(H,20,21)