[(2R,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-hex-5-enyl] benzoate

Systemtic Name: [(2R,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-hex-5-enyl] benzoate Openeye Name: [(2R,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-methyl-hex-5-enyl] benzoate CAS Name: benzoic acid [(2R,3R)-3-hydroxy-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hex-5-enyl] ester IUPAC Name: [(2R,3R)-3-hydroxy-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-enyl] benzoate Traditional Name: benzoic acid [(2R,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-methyl-hex-5-enyl] ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COC(=O)C1=CC=CC=C1)C(C)(CC=C)O

Isomeric SMILES

C[C@@](CC=C)([C@@H](COC(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C19H27NO5/c1-6-12-19(5,23)15(20-17(22)25-18(2,3)4)13-24-16(21)14-10-8-7-9-11-14/h6-11,15,23H,1,12-13H2,2-5H3,(H,20,22)/t15-,19-/m1/s1