tert-butyl 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-hexanoate

Systemtic Name: tert-butyl 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-bromanyl-hexanoate Openeye Name: tert-butyl 2-bromo-6-(1,3-dioxoisoindolin-2-yl)hexanoate CAS Name: 2-bromo-6-(1,3-dioxo-2-isoindolyl)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-bromo-6-(1,3-dioxoisoindol-2-yl)hexanoate Traditional Name: 2-bromo-6-phthalimido-hexanoic acid tert-butyl ester Formula: C18H22BrNO4 MolecularWeight: 396.27558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCN1C(=O)C2=CC=CC=C2C1=O)Br

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCN1C(=O)C2=CC=CC=C2C1=O)Br

InChI

InChI=1S/C18H22BrNO4/c1-18(2,3)24-17(23)14(19)10-6-7-11-20-15(21)12-8-4-5-9-13(12)16(20)22/h4-5,8-9,14H,6-7,10-11H2,1-3H3