tert-butyl N-[(E)-1-fluoranyl-5-phenyl-1-(phenylsulfonyl)pent-1-en-3-yl]carbamate

Systemtic Name: tert-butyl N-[(E)-1-fluoranyl-5-phenyl-1-(phenylsulfonyl)pent-1-en-3-yl]carbamate Openeye Name: tert-butyl N-[(E)-3-(benzenesulfonyl)-3-fluoro-1-phenethyl-allyl]carbamate CAS Name: N-[(E)-1-(benzenesulfonyl)-1-fluoro-5-phenylpent-1-en-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-1-(benzenesulfonyl)-1-fluoro-5-phenylpent-1-en-3-yl]carbamate Traditional Name: N-[(E)-3-besyl-3-fluoro-1-phenethyl-allyl]carbamic acid tert-butyl ester Formula: C22H26FNO4S MolecularWeight: 419.509543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=CC=CC=C1)C=C(F)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC1=CC=CC=C1)/C=C(\F)/S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26FNO4S/c1-22(2,3)28-21(25)24-18(15-14-17-10-6-4-7-11-17)16-20(23)29(26,27)19-12-8-5-9-13-19/h4-13,16,18H,14-15H2,1-3H3,(H,24,25)/b20-16+