tert-butyl 2-cyclopentyl-2-[4-[1-(3-methylphenyl)sulfonyloxypropyl]phenyl]ethanoate

Systemtic Name: tert-butyl 2-cyclopentyl-2-[4-[1-(3-methylphenyl)sulfonyloxypropyl]phenyl]ethanoate Openeye Name: tert-butyl 2-cyclopentyl-2-[4-[1-(m-tolylsulfonyloxy)propyl]phenyl]acetate CAS Name: 2-cyclopentyl-2-[4-[1-(3-methylphenyl)sulfonyloxypropyl]phenyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyclopentyl-2-[4-[1-(3-methylphenyl)sulfonyloxypropyl]phenyl]acetate Traditional Name: 2-cyclopentyl-2-[4-[1-(m-tolylsulfonyloxy)propyl]phenyl]acetic acid tert-butyl ester Formula: C27H36O5S MolecularWeight: 472.63674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(C2CCCC2)C(=O)OC(C)(C)C)OS(=O)(=O)C3=CC=CC(=C3)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(C2CCCC2)C(=O)OC(C)(C)C)OS(=O)(=O)C3=CC=CC(=C3)C

InChI

InChI=1S/C27H36O5S/c1-6-24(32-33(29,30)23-13-9-10-19(2)18-23)20-14-16-22(17-15-20)25(21-11-7-8-12-21)26(28)31-27(3,4)5/h9-10,13-18,21,24-25H,6-8,11-12H2,1-5H3