3-ethyl-5-methyl-2-(5-nitrofuran-2-yl)cyclopent-2-en-1-one

Systemtic Name: 3-ethyl-5-methyl-2-(5-nitrofuran-2-yl)cyclopent-2-en-1-one Openeye Name: 3-ethyl-5-methyl-2-(5-nitro-2-furyl)cyclopent-2-en-1-one CAS Name: 3-ethyl-5-methyl-2-(5-nitro-2-furanyl)-1-cyclopent-2-enone IUPAC Name: 3-ethyl-5-methyl-2-(5-nitrofuran-2-yl)cyclopent-2-en-1-one Traditional Name: 3-ethyl-5-methyl-2-(5-nitro-2-furyl)cyclopent-2-en-1-one Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C(C1)C)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=O)C(C1)C)C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-3-8-6-7(2)12(14)11(8)9-4-5-10(17-9)13(15)16/h4-5,7H,3,6H2,1-2H3