(3R,4R)-1-[(R)-tert-butylsulfinyl]-3-methyl-4-(4-nitrophenyl)-4-oxidanyl-butan-2-one

Systemtic Name: (3R,4R)-1-[(R)-tert-butylsulfinyl]-3-methyl-4-(4-nitrophenyl)-4-oxidanyl-butan-2-one Openeye Name: (3R,4R)-1-[(R)-tert-butylsulfinyl]-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one CAS Name: (3R,4R)-1-[(R)-tert-butylsulfinyl]-4-hydroxy-3-methyl-4-(4-nitrophenyl)-2-butanone IUPAC Name: (3R,4R)-1-[(R)-tert-butylsulfinyl]-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one Traditional Name: (3R,4R)-1-[(R)-tert-butylsulfinyl]-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)C(=O)CS(=O)C(C)(C)C

Isomeric SMILES

C[C@H]([C@H](C1=CC=C(C=C1)[N+](=O)[O-])O)C(=O)C[S@@](=O)C(C)(C)C

InChI

InChI=1S/C15H21NO5S/c1-10(13(17)9-22(21)15(2,3)4)14(18)11-5-7-12(8-6-11)16(19)20/h5-8,10,14,18H,9H2,1-4H3/t10-,14+,22+/m0/s1