(3R)-3-[(S)-(4-nitrophenyl)-oxidanyl-methyl]oxan-4-one

Systemtic Name: (3R)-3-[(S)-(4-nitrophenyl)-oxidanyl-methyl]oxan-4-one Openeye Name: (3R)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]tetrahydropyran-4-one CAS Name: (3R)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]-4-oxanone IUPAC Name: (3R)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]oxan-4-one Traditional Name: (3R)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]tetrahydropyran-4-one Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC(C1=O)C(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1COC[C@@H](C1=O)[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H13NO5/c14-11-5-6-18-7-10(11)12(15)8-1-3-9(4-2-8)13(16)17/h1-4,10,12,15H,5-7H2/t10-,12+/m0/s1