(4R)-4-(5-methoxy-2-nitro-phenyl)-4-oxidanyl-butan-2-one

Systemtic Name: (4R)-4-(5-methoxy-2-nitro-phenyl)-4-oxidanyl-butan-2-one Openeye Name: (4R)-4-hydroxy-4-(5-methoxy-2-nitro-phenyl)butan-2-one CAS Name: (4R)-4-hydroxy-4-(5-methoxy-2-nitrophenyl)-2-butanone IUPAC Name: (4R)-4-hydroxy-4-(5-methoxy-2-nitrophenyl)butan-2-one Traditional Name: (4R)-4-hydroxy-4-(5-methoxy-2-nitro-phenyl)butan-2-one Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5/c1-7(13)5-11(14)9-6-8(17-2)3-4-10(9)12(15)16/h3-4,6,11,14H,5H2,1-2H3/t11-/m1/s1