[11-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-bromanyl-undecan-2-yl] ethanoate

Systemtic Name: [11-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-bromanyl-undecan-2-yl] ethanoate Openeye Name: [1-(bromomethyl)-10-(1,3-dioxoisoindolin-2-yl)decyl] acetate CAS Name: acetic acid [1-bromo-11-(1,3-dioxo-2-isoindolyl)undecan-2-yl] ester IUPAC Name: [1-bromo-11-(1,3-dioxoisoindol-2-yl)undecan-2-yl] acetate Traditional Name: acetic acid [1-(bromomethyl)-10-phthalimido-decyl] ester Formula: C21H28BrNO4 MolecularWeight: 438.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O)CBr

Isomeric SMILES

CC(=O)OC(CCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O)CBr

InChI

InChI=1S/C21H28BrNO4/c1-16(24)27-17(15-22)11-7-5-3-2-4-6-10-14-23-20(25)18-12-8-9-13-19(18)21(23)26/h8-9,12-13,17H,2-7,10-11,14-15H2,1H3