tert-butyl N-[1-[4-[(E)-4-bromanylbut-2-enyl]-5-oxidanylidene-oxolan-2-yl]-2-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[1-[4-[(E)-4-bromanylbut-2-enyl]-5-oxidanylidene-oxolan-2-yl]-2-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[1-[4-[(E)-4-bromobut-2-enyl]-5-oxo-tetrahydrofuran-2-yl]-2-phenyl-ethyl]carbamate CAS Name: N-[1-[4-[(E)-4-bromobut-2-enyl]-5-oxo-2-oxolanyl]-2-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-[(E)-4-bromobut-2-enyl]-5-oxooxolan-2-yl]-2-phenylethyl]carbamate Traditional Name: N-[1-[4-[(E)-4-bromobut-2-enyl]-5-keto-tetrahydrofuran-2-yl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C21H28BrNO4 MolecularWeight: 438.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2CC(C(=O)O2)CC=CCBr

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2CC(C(=O)O2)C/C=C/CBr

InChI

InChI=1S/C21H28BrNO4/c1-21(2,3)27-20(25)23-17(13-15-9-5-4-6-10-15)18-14-16(19(24)26-18)11-7-8-12-22/h4-10,16-18H,11-14H2,1-3H3,(H,23,25)/b8-7+