2-[3-(tert-butylcarbamoyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[3-(tert-butylcarbamoyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[3-(tert-butylcarbamoyl)phenyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[3-[(tert-butylamino)-oxomethyl]phenyl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[3-(tert-butylcarbamoyl)phenyl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-[3-(tert-butylcarbamoyl)phenyl]-1,3-diketo-isoindoline-5-carboxylic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N2O5/c1-20(2,3)21-16(23)11-5-4-6-13(9-11)22-17(24)14-8-7-12(19(26)27)10-15(14)18(22)25/h4-10H,1-3H3,(H,21,23)(H,26,27)