[(2R,3R,5R,6S)-5-acetyloxy-2-methoxy-6-methyl-4-oxidanylidene-oxan-3-yl] benzoate

Systemtic Name: [(2R,3R,5R,6S)-5-acetyloxy-2-methoxy-6-methyl-4-oxidanylidene-oxan-3-yl] benzoate Openeye Name: [(2R,3R,5R,6S)-5-acetoxy-2-methoxy-6-methyl-4-oxo-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,5R,6S)-5-acetyloxy-2-methoxy-6-methyl-4-oxo-3-oxanyl] ester IUPAC Name: [(2R,3R,5R,6S)-5-acetyloxy-2-methoxy-6-methyl-4-oxooxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,5R,6S)-5-acetoxy-4-keto-2-methoxy-6-methyl-tetrahydropyran-3-yl] ester Formula: C16H18O7 MolecularWeight: 322.30992

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C(C(O1)OC)OC(=O)C2=CC=CC=C2)OC(=O)C

Isomeric SMILES

C[C@H]1[C@H](C(=O)[C@@H]([C@@H](O1)OC)OC(=O)C2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C16H18O7/c1-9-13(22-10(2)17)12(18)14(16(20-3)21-9)23-15(19)11-7-5-4-6-8-11/h4-9,13-14,16H,1-3H3/t9-,13+,14-,16+/m0/s1