[(2S)-1-[(4S,5R)-5-methanoyl-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl] benzoate

Systemtic Name: [(2S)-1-[(4S,5R)-5-methanoyl-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl] benzoate Openeye Name: [(1S)-2-[(4S,5R)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]-1-methyl-ethyl] benzoate CAS Name: benzoic acid [(2S)-1-[(4S,5R)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl] ester IUPAC Name: [(2S)-1-[(4S,5R)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]propan-2-yl] benzoate Traditional Name: benzoic acid [(1S)-2-[(4S,5R)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]-1-methyl-ethyl] ester Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O5/c1-11(19-15(18)12-7-5-4-6-8-12)9-13-14(10-17)21-16(2,3)20-13/h4-8,10-11,13-14H,9H2,1-3H3/t11-,13-,14-/m0/s1