(NE)-N-[[3-(5-nitrofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methylidene]hydroxylamine

Systemtic Name: (NE)-N-[[3-(5-nitrofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methylidene]hydroxylamine Openeye Name: (4E)-1-benzyl-3-(5-nitro-2-furyl)pyrazole-4-carbaldehyde oxime CAS Name: (4E)-3-(5-nitro-2-furanyl)-1-(phenylmethyl)-4-pyrazolecarboxaldehyde oxime IUPAC Name: (NE)-N-[[1-benzyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylidene]hydroxylamine Traditional Name: (4E)-1-benzyl-3-(5-nitro-2-furyl)pyrazole-4-carbaldehyde oxime Formula: C15H12N4O4 MolecularWeight: 312.28018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C=NO

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])/C=N/O

InChI

InChI=1S/C15H12N4O4/c20-16-8-12-10-18(9-11-4-2-1-3-5-11)17-15(12)13-6-7-14(23-13)19(21)22/h1-8,10,20H,9H2/b16-8+