2-methyl-N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzamide

Systemtic Name: 2-methyl-N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzamide Openeye Name: 2-methyl-N-[(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide CAS Name: 2-methyl-N-[(E)-[3-(5-nitro-2-furanyl)-1-phenyl-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 2-methyl-N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]benzamide Traditional Name: 2-methyl-N-[(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide Formula: C22H17N5O4 MolecularWeight: 415.40148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NN=CC2=CN(N=C2C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N/N=C/C2=CN(N=C2C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N5O4/c1-15-7-5-6-10-18(15)22(28)24-23-13-16-14-26(17-8-3-2-4-9-17)25-21(16)19-11-12-20(31-19)27(29)30/h2-14H,1H3,(H,24,28)/b23-13+