[(1R)-1-[(4S)-4-oxidanyl-3-oxidanylidene-1H-isochromen-4-yl]ethyl] (2R)-2-acetyloxy-2-phenyl-ethanoate

Systemtic Name: [(1R)-1-[(4S)-4-oxidanyl-3-oxidanylidene-1H-isochromen-4-yl]ethyl] (2R)-2-acetyloxy-2-phenyl-ethanoate Openeye Name: [(1R)-1-[(4S)-4-hydroxy-3-oxo-isochroman-4-yl]ethyl] (2R)-2-acetoxy-2-phenyl-acetate CAS Name: (2R)-2-acetyloxy-2-phenylacetic acid [(1R)-1-[(4S)-4-hydroxy-3-oxo-3,4-dihydro-1H-2-benzopyran-4-yl]ethyl] ester IUPAC Name: [(1R)-1-[(4S)-4-hydroxy-3-oxo-1H-isochromen-4-yl]ethyl] (2R)-2-acetyloxy-2-phenylacetate Traditional Name: (2R)-2-acetoxy-2-phenyl-acetic acid [(1R)-1-[(4S)-4-hydroxy-3-keto-isochroman-4-yl]ethyl] ester Formula: C21H20O7 MolecularWeight: 384.3793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(C2=CC=CC=C2COC1=O)O)OC(=O)C(C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

C[C@H]([C@]1(C2=CC=CC=C2COC1=O)O)OC(=O)[C@@H](C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C21H20O7/c1-13(21(25)17-11-7-6-10-16(17)12-26-20(21)24)27-19(23)18(28-14(2)22)15-8-4-3-5-9-15/h3-11,13,18,25H,12H2,1-2H3/t13-,18-,21-/m1/s1