methyl (3R,4S,5R)-4,5-diacetyloxy-3-bis(phenylmethoxy)phosphoryloxy-cyclohexene-1-carboxylate

Systemtic Name: methyl (3R,4S,5R)-4,5-diacetyloxy-3-bis(phenylmethoxy)phosphoryloxy-cyclohexene-1-carboxylate Openeye Name: methyl (3R,4S,5R)-4,5-diacetoxy-3-dibenzyloxyphosphoryloxy-cyclohexene-1-carboxylate CAS Name: (3R,4S,5R)-4,5-diacetyloxy-3-bis(phenylmethoxy)phosphoryloxy-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S,5R)-4,5-diacetyloxy-3-bis(phenylmethoxy)phosphoryloxycyclohexene-1-carboxylate Traditional Name: (3R,4S,5R)-4,5-diacetoxy-3-dibenzoxyphosphoryloxy-cyclohexene-1-carboxylic acid methyl ester Formula: C26H29O10P MolecularWeight: 532.476221

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=CC(C1OC(=O)C)OP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)O[C@@H]1CC(=C[C@H]([C@H]1OC(=O)C)OP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H29O10P/c1-18(27)34-23-14-22(26(29)31-3)15-24(25(23)35-19(2)28)36-37(30,32-16-20-10-6-4-7-11-20)33-17-21-12-8-5-9-13-21/h4-13,15,23-25H,14,16-17H2,1-3H3/t23-,24-,25+/m1/s1