1-(4-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-(2-methoxy-5-nitrophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-N-(2-methoxy-5-nitrophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H19FN4O4 MolecularWeight: 410.398363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O4/c1-30-19-11-10-15(26(28)29)12-17(19)23-21(27)20-16-4-2-3-5-18(16)25(24-20)14-8-6-13(22)7-9-14/h6-12H,2-5H2,1H3,(H,23,27)