[(2S,3R,4S,5R)-4,5-bis(oxidanyl)-2-phenylmethoxy-oxan-3-yl] 4-methoxybenzoate

Systemtic Name: [(2S,3R,4S,5R)-4,5-bis(oxidanyl)-2-phenylmethoxy-oxan-3-yl] 4-methoxybenzoate Openeye Name: [(2S,3R,4S,5R)-2-benzyloxy-4,5-dihydroxy-tetrahydropyran-3-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2S,3R,4S,5R)-4,5-dihydroxy-2-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3R,4S,5R)-4,5-dihydroxy-2-phenylmethoxyoxan-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(2S,3R,4S,5R)-2-benzoxy-4,5-dihydroxy-tetrahydropyran-3-yl] ester Formula: C20H22O7 MolecularWeight: 374.38448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2C(C(COC2OCC3=CC=CC=C3)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)O[C@@H]2[C@H]([C@@H](CO[C@@H]2OCC3=CC=CC=C3)O)O

InChI

InChI=1S/C20H22O7/c1-24-15-9-7-14(8-10-15)19(23)27-18-17(22)16(21)12-26-20(18)25-11-13-5-3-2-4-6-13/h2-10,16-18,20-22H,11-12H2,1H3/t16-,17+,18-,20+/m1/s1