(3S,4S,5R)-2-(4-methylphenyl)-4-nitro-3-phenyl-5-(phenylsulfonyl)-1,2-oxazolidine

Systemtic Name: (3S,4S,5R)-2-(4-methylphenyl)-4-nitro-3-phenyl-5-(phenylsulfonyl)-1,2-oxazolidine Openeye Name: (3S,4S,5R)-5-(benzenesulfonyl)-4-nitro-3-phenyl-2-(p-tolyl)isoxazolidine CAS Name: (3S,4S,5R)-5-(benzenesulfonyl)-2-(4-methylphenyl)-4-nitro-3-phenylisoxazolidine IUPAC Name: (3S,4S,5R)-5-(benzenesulfonyl)-2-(4-methylphenyl)-4-nitro-3-phenyl-1,2-oxazolidine Traditional Name: (3S,4S,5R)-5-besyl-4-nitro-3-phenyl-2-(p-tolyl)isoxazolidine Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(C(O2)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@H]([C@@H]([C@H](O2)S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O5S/c1-16-12-14-18(15-13-16)23-20(17-8-4-2-5-9-17)21(24(25)26)22(29-23)30(27,28)19-10-6-3-7-11-19/h2-15,20-22H,1H3/t20-,21-,22+/m0/s1