[(E,2S,3R)-2,3-diacetyloxy-6-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-ynyl-amino]hex-4-enyl] ethanoate

Systemtic Name: [(E,2S,3R)-2,3-diacetyloxy-6-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-ynyl-amino]hex-4-enyl] ethanoate Openeye Name: [(E,2S,3R)-2,3-diacetoxy-6-[tert-butoxycarbonyl(prop-2-ynyl)amino]hex-4-enyl] acetate CAS Name: acetic acid [(E,2S,3R)-2,3-diacetyloxy-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]-prop-2-ynylamino]hex-4-enyl] ester IUPAC Name: [(E,2S,3R)-2,3-diacetyloxy-6-[(2-methylpropan-2-yl)oxycarbonyl-prop-2-ynylamino]hex-4-enyl] acetate Traditional Name: acetic acid [(E,2S,3R)-2,3-diacetoxy-6-[tert-butoxycarbonyl(propargyl)amino]hex-4-enyl] ester Formula: C20H29NO8 MolecularWeight: 411.44616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C=CCN(CC#C)C(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]([C@@H](/C=C/CN(CC#C)C(=O)OC(C)(C)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H29NO8/c1-8-11-21(19(25)29-20(5,6)7)12-9-10-17(27-15(3)23)18(28-16(4)24)13-26-14(2)22/h1,9-10,17-18H,11-13H2,2-7H3/b10-9+/t17-,18+/m1/s1