(2S)-2-[(2S,4R)-3-(4-methylphenyl)sulfonyl-4-phenyl-1,3-oxazolidin-2-yl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(2S,4R)-3-(4-methylphenyl)sulfonyl-4-phenyl-1,3-oxazolidin-2-yl]cyclohexan-1-one Openeye Name: (2S)-2-[(2S,4R)-4-phenyl-3-(p-tolylsulfonyl)oxazolidin-2-yl]cyclohexanone CAS Name: (2S)-2-[(2S,4R)-3-(4-methylphenyl)sulfonyl-4-phenyl-2-oxazolidinyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(2S,4R)-3-(4-methylphenyl)sulfonyl-4-phenyl-1,3-oxazolidin-2-yl]cyclohexan-1-one Traditional Name: (2S)-2-[(2S,4R)-4-phenyl-3-tosyl-oxazolidin-2-yl]cyclohexanone Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(COC2C3CCCCC3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CO[C@H]2[C@@H]3CCCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C22H25NO4S/c1-16-11-13-18(14-12-16)28(25,26)23-20(17-7-3-2-4-8-17)15-27-22(23)19-9-5-6-10-21(19)24/h2-4,7-8,11-14,19-20,22H,5-6,9-10,15H2,1H3/t19-,20+,22+/m1/s1