methyl 2-[4-(2-methylpropoxycarbonyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: methyl 2-[4-(2-methylpropoxycarbonyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: methyl 2-(4-isobutoxycarbonylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[2-methylpropoxy(oxo)methyl]phenyl]-1,3-dioxo-5-isoindolecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(2-methylpropoxycarbonyl)phenyl]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-isobutoxycarbonylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid methyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H19NO6/c1-12(2)11-28-21(26)13-4-7-15(8-5-13)22-18(23)16-9-6-14(20(25)27-3)10-17(16)19(22)24/h4-10,12H,11H2,1-3H3