tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[(E)-3-oxidanyl-5-(phenylsulfonyl)pent-4-enyl]carbamate

Systemtic Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[(E)-3-oxidanyl-5-(phenylsulfonyl)pent-4-enyl]carbamate Openeye Name: tert-butyl N-[(E)-5-(benzenesulfonyl)-3-hydroxy-pent-4-enyl]-N-tert-butoxycarbonyl-carbamate CAS Name: N-[(E)-5-(benzenesulfonyl)-3-hydroxypent-4-enyl]-N-[(2-methylpropan-2-yl)oxy-oxomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-5-(benzenesulfonyl)-3-hydroxypent-4-enyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Traditional Name: N-[(E)-5-besyl-3-hydroxy-pent-4-enyl]-N-tert-butoxycarbonyl-carbamic acid tert-butyl ester Formula: C21H31NO7S MolecularWeight: 441.53834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCC(C=CS(=O)(=O)C1=CC=CC=C1)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(CCC(/C=C/S(=O)(=O)C1=CC=CC=C1)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO7S/c1-20(2,3)28-18(24)22(19(25)29-21(4,5)6)14-12-16(23)13-15-30(26,27)17-10-8-7-9-11-17/h7-11,13,15-16,23H,12,14H2,1-6H3/b15-13+