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

Systemtic Name: 5-ethyl-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carbaldehyde Openeye Name: 5-ethyl-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carbaldehyde CAS Name: 5-ethyl-4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]-2-thiophenecarboxaldehyde IUPAC Name: 5-ethyl-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]thiophene-2-carbaldehyde Traditional Name: 5-ethyl-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carbaldehyde Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O3S/c1-3-11-9(5-10(7-16)19-11)6-14-8(2)4-12(13-14)15(17)18/h4-5,7H,3,6H2,1-2H3