2-butan-2-yl-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-butan-2-yl-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-sec-butyl-isoindoline-5-carboxylic acid CAS Name: 2-butan-2-yl-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-butan-2-yl-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-sec-butyl-isoindoline-5-carboxylic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13NO4/c1-3-7(2)14-11(15)9-5-4-8(13(17)18)6-10(9)12(14)16/h4-7H,3H2,1-2H3,(H,17,18)