N-[(E)-[3-(5-nitrofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]ethanamide

Systemtic Name: N-[(E)-[3-(5-nitrofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]ethanamide Openeye Name: N-[(E)-[1-benzyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]acetamide CAS Name: N-[(E)-[3-(5-nitro-2-furanyl)-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: N-[(E)-[1-benzyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]acetamide Traditional Name: N-[(E)-[1-benzyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]acetamide Formula: C17H15N5O4 MolecularWeight: 353.3321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC(=O)N/N=C/C1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C17H15N5O4/c1-12(23)19-18-9-14-11-21(10-13-5-3-2-4-6-13)20-17(14)15-7-8-16(26-15)22(24)25/h2-9,11H,10H2,1H3,(H,19,23)/b18-9+