N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-nitro-furan-2-carboxamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-nitro-2-furamide Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O4/c26-21(18-11-12-19(29-18)25(27)28)22-13-16-14-24(17-9-5-2-6-10-17)23-20(16)15-7-3-1-4-8-15/h1-12,14H,13H2,(H,22,26)