(4S)-4-tert-butylsulfanyl-4-(4-nitrophenyl)butan-2-one

Systemtic Name: (4S)-4-tert-butylsulfanyl-4-(4-nitrophenyl)butan-2-one Openeye Name: (4S)-4-tert-butylsulfanyl-4-(4-nitrophenyl)butan-2-one CAS Name: (4S)-4-(tert-butylthio)-4-(4-nitrophenyl)-2-butanone IUPAC Name: (4S)-4-tert-butylsulfanyl-4-(4-nitrophenyl)butan-2-one Traditional Name: (4S)-4-(tert-butylthio)-4-(4-nitrophenyl)butan-2-one Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3S/c1-10(16)9-13(19-14(2,3)4)11-5-7-12(8-6-11)15(17)18/h5-8,13H,9H2,1-4H3/t13-/m0/s1