(3,3-dimethyl-2-oxidanylidene-butyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 1,3-bis(oxidanylidene)-2-phenyl-isoindole-5-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 1,3-dioxo-2-phenyl-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-phenyl-5-isoindolecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 1,3-dioxo-2-phenylisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-phenyl-isoindoline-5-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO5/c1-21(2,3)17(23)12-27-20(26)13-9-10-15-16(11-13)19(25)22(18(15)24)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3