3-(4-methoxyphenyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-methoxyphenyl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[(E)-(5-nitro-2-furanyl)methylideneamino]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-methoxyphenyl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]-1-phenyl-pyrazole-4-carboxamide Formula: C22H17N5O5 MolecularWeight: 431.40088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NN=CC3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N/N=C/C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N5O5/c1-31-17-9-7-15(8-10-17)21-19(14-26(25-21)16-5-3-2-4-6-16)22(28)24-23-13-18-11-12-20(32-18)27(29)30/h2-14H,1H3,(H,24,28)/b23-13+