2,2-dimethyl-1-[4-(2-nitropropan-2-yl)furan-2-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-(2-nitropropan-2-yl)furan-2-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[4-(1-methyl-1-nitro-ethyl)-2-furyl]propan-1-one CAS Name: 2,2-dimethyl-1-[4-(2-nitropropan-2-yl)-2-furanyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-(2-nitropropan-2-yl)furan-2-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[4-(1-methyl-1-nitro-ethyl)-2-furyl]propan-1-one Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC(=CO1)C(C)(C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)C1=CC(=CO1)C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C12H17NO4/c1-11(2,3)10(14)9-6-8(7-17-9)12(4,5)13(15)16/h6-7H,1-5H3