(4R)-4-(4-nitro-1,3-benzodioxol-5-yl)-4-oxidanyl-butan-2-one

Systemtic Name: (4R)-4-(4-nitro-1,3-benzodioxol-5-yl)-4-oxidanyl-butan-2-one Openeye Name: (4R)-4-hydroxy-4-(4-nitro-1,3-benzodioxol-5-yl)butan-2-one CAS Name: (4R)-4-hydroxy-4-(4-nitro-1,3-benzodioxol-5-yl)-2-butanone IUPAC Name: (4R)-4-hydroxy-4-(4-nitro-1,3-benzodioxol-5-yl)butan-2-one Traditional Name: (4R)-4-hydroxy-4-(4-nitro-1,3-benzodioxol-5-yl)butan-2-one Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=C(C2=C(C=C1)OCO2)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)C[C@H](C1=C(C2=C(C=C1)OCO2)[N+](=O)[O-])O

InChI

InChI=1S/C11H11NO6/c1-6(13)4-8(14)7-2-3-9-11(18-5-17-9)10(7)12(15)16/h2-3,8,14H,4-5H2,1H3/t8-/m1/s1