1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbaldehyde

Systemtic Name: 1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbaldehyde Openeye Name: 1-hexyl-3-(5-nitro-2-furyl)pyrazole-4-carbaldehyde CAS Name: 1-hexyl-3-(5-nitro-2-furanyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbaldehyde Traditional Name: 1-hexyl-3-(5-nitro-2-furyl)pyrazole-4-carbaldehyde Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])C=O

Isomeric SMILES

CCCCCCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])C=O

InChI

InChI=1S/C14H17N3O4/c1-2-3-4-5-8-16-9-11(10-18)14(15-16)12-6-7-13(21-12)17(19)20/h6-7,9-10H,2-5,8H2,1H3