[(1S,2R)-4,4-dimethyl-1-phenyl-2-(phenylsulfonyl)pentyl] ethanoate

Systemtic Name: [(1S,2R)-4,4-dimethyl-1-phenyl-2-(phenylsulfonyl)pentyl] ethanoate Openeye Name: [(1S,2R)-2-(benzenesulfonyl)-4,4-dimethyl-1-phenyl-pentyl] acetate CAS Name: acetic acid [(1S,2R)-2-(benzenesulfonyl)-4,4-dimethyl-1-phenylpentyl] ester IUPAC Name: [(1S,2R)-2-(benzenesulfonyl)-4,4-dimethyl-1-phenylpentyl] acetate Traditional Name: acetic acid [(1S,2R)-2-besyl-4,4-dimethyl-1-phenyl-pentyl] ester Formula: C21H26O4S MolecularWeight: 374.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(CC(C)(C)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@@H](C1=CC=CC=C1)[C@@H](CC(C)(C)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H26O4S/c1-16(22)25-20(17-11-7-5-8-12-17)19(15-21(2,3)4)26(23,24)18-13-9-6-10-14-18/h5-14,19-20H,15H2,1-4H3/t19-,20+/m1/s1