5-ethyl-4-[[4-nitro-3-(trifluoromethyl)pyrazol-1-yl]methyl]thiophene-2-carbaldehyde

Systemtic Name: 5-ethyl-4-[[4-nitro-3-(trifluoromethyl)pyrazol-1-yl]methyl]thiophene-2-carbaldehyde Openeye Name: 5-ethyl-4-[[4-nitro-3-(trifluoromethyl)pyrazol-1-yl]methyl]thiophene-2-carbaldehyde CAS Name: 5-ethyl-4-[[4-nitro-3-(trifluoromethyl)-1-pyrazolyl]methyl]-2-thiophenecarboxaldehyde IUPAC Name: 5-ethyl-4-[[4-nitro-3-(trifluoromethyl)pyrazol-1-yl]methyl]thiophene-2-carbaldehyde Traditional Name: 5-ethyl-4-[[4-nitro-3-(trifluoromethyl)pyrazol-1-yl]methyl]thiophene-2-carbaldehyde Formula: C12H10F3N3O3S MolecularWeight: 333.28631

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C=O)CN2C=C(C(=N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(S1)C=O)CN2C=C(C(=N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H10F3N3O3S/c1-2-10-7(3-8(6-19)22-10)4-17-5-9(18(20)21)11(16-17)12(13,14)15/h3,5-6H,2,4H2,1H3