[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]-pyrazol-1-yl-methanone

Systemtic Name: [5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]-pyrazol-1-yl-methanone Openeye Name: [5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furyl]-pyrazol-1-yl-methanone CAS Name: [5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furanyl]-(1-pyrazolyl)methanone IUPAC Name: [5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]furan-2-yl]-pyrazol-1-ylmethanone Traditional Name: [5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furyl]-pyrazol-1-yl-methanone Formula: C14H13N5O4 MolecularWeight: 315.28412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)N3C=CC=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)N3C=CC=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O4/c1-9-13(19(21)22)10(2)18(16-9)8-11-4-5-12(23-11)14(20)17-7-3-6-15-17/h3-7H,8H2,1-2H3