4-[[(2R,3R,4S)-2,3,4,5-tetraacetyloxypentanoyl]amino]benzoate

Systemtic Name: 4-[[(2R,3R,4S)-2,3,4,5-tetraacetyloxypentanoyl]amino]benzoate Openeye Name: 4-[[(2R,3R,4S)-2,3,4,5-tetraacetoxypentanoyl]amino]benzoate CAS Name: 4-[[(2R,3R,4S)-2,3,4,5-tetraacetyloxy-1-oxopentyl]amino]benzoate IUPAC Name: 4-[[(2R,3R,4S)-2,3,4,5-tetraacetyloxypentanoyl]amino]benzoate Traditional Name: 4-[[(2R,3R,4S)-2,3,4,5-tetraacetoxypentanoyl]amino]benzoate Formula: C20H22NO11- MolecularWeight: 452.38878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C(C(=O)NC1=CC=C(C=C1)C(=O)[O-])OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]([C@H]([C@H](C(=O)NC1=CC=C(C=C1)C(=O)[O-])OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H23NO11/c1-10(22)29-9-16(30-11(2)23)17(31-12(3)24)18(32-13(4)25)19(26)21-15-7-5-14(6-8-15)20(27)28/h5-8,16-18H,9H2,1-4H3,(H,21,26)(H,27,28)/p-1/t16-,17+,18+/m0/s1