[2-ethanoyl-4-(3-methyl-3-oxidanyl-butyl)-3-(4-methylphenyl)sulfonyloxy-5-(phenylcarbonyloxy)phenyl] benzoate

Systemtic Name: [2-ethanoyl-4-(3-methyl-3-oxidanyl-butyl)-3-(4-methylphenyl)sulfonyloxy-5-(phenylcarbonyloxy)phenyl] benzoate Openeye Name: [2-acetyl-5-benzoyloxy-4-(3-hydroxy-3-methyl-butyl)-3-(p-tolylsulfonyloxy)phenyl] benzoate CAS Name: benzoic acid [2-acetyl-5-benzoyloxy-4-(3-hydroxy-3-methylbutyl)-3-(4-methylphenyl)sulfonyloxyphenyl] ester IUPAC Name: [2-acetyl-5-benzoyloxy-4-(3-hydroxy-3-methylbutyl)-3-(4-methylphenyl)sulfonyloxyphenyl] benzoate Traditional Name: benzoic acid [2-acetyl-5-benzoyloxy-4-(3-hydroxy-3-methyl-butyl)-3-tosyloxy-phenyl] ester Formula: C34H32O9S MolecularWeight: 616.67748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=CC(=C2CCC(C)(C)O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=CC(=C2CCC(C)(C)O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C34H32O9S/c1-22-15-17-26(18-16-22)44(39,40)43-31-27(19-20-34(3,4)38)28(41-32(36)24-11-7-5-8-12-24)21-29(30(31)23(2)35)42-33(37)25-13-9-6-10-14-25/h5-18,21,38H,19-20H2,1-4H3