[3,4-bis(oxidanyl)-1-oxidanylidene-5-(triphenylmethyl)oxy-pentan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [3,4-bis(oxidanyl)-1-oxidanylidene-5-(triphenylmethyl)oxy-pentan-2-yl] 4-methylbenzenesulfonate Openeye Name: (1-formyl-2,3-dihydroxy-4-trityloxy-butyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,4-dihydroxy-1-oxo-5-(triphenylmethyl)oxypentan-2-yl] ester IUPAC Name: (3,4-dihydroxy-1-oxo-5-trityloxypentan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-formyl-2,3-dihydroxy-4-trityloxy-butyl) ester Formula: C31H30O7S MolecularWeight: 546.6307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C=O)C(C(COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C=O)C(C(COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O)O

InChI

InChI=1S/C31H30O7S/c1-23-17-19-27(20-18-23)39(35,36)38-29(21-32)30(34)28(33)22-37-31(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-21,28-30,33-34H,22H2,1H3