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

Systemtic Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitrophenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H19FN4O3 MolecularWeight: 394.398963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O3/c1-13-17(6-4-8-18(13)26(28)29)23-21(27)20-16-5-2-3-7-19(16)25(24-20)15-11-9-14(22)10-12-15/h4,6,8-12H,2-3,5,7H2,1H3,(H,23,27)