(2R)-4-tert-butyl-2-[(S)-(4-nitrophenyl)-oxidanyl-methyl]cyclohexan-1-one

Systemtic Name: (2R)-4-tert-butyl-2-[(S)-(4-nitrophenyl)-oxidanyl-methyl]cyclohexan-1-one Openeye Name: (2R)-4-tert-butyl-2-[(S)-hydroxy-(4-nitrophenyl)methyl]cyclohexanone CAS Name: (2R)-4-tert-butyl-2-[(S)-hydroxy-(4-nitrophenyl)methyl]-1-cyclohexanone IUPAC Name: (2R)-4-tert-butyl-2-[(S)-hydroxy-(4-nitrophenyl)methyl]cyclohexan-1-one Traditional Name: (2R)-4-tert-butyl-2-[(S)-hydroxy-(4-nitrophenyl)methyl]cyclohexanone Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=O)C(C1)C(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)C1CCC(=O)[C@H](C1)[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H23NO4/c1-17(2,3)12-6-9-15(19)14(10-12)16(20)11-4-7-13(8-5-11)18(21)22/h4-5,7-8,12,14,16,20H,6,9-10H2,1-3H3/t12?,14-,16+/m0/s1