1-(2-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(2-fluorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-fluorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H16FN5O4 MolecularWeight: 421.381243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

InChI

InChI=1S/C21H16FN5O4/c1-31-19-9-8-14(27(29)30)12-17(19)24-20(28)15-13-23-26(18-7-3-2-6-16(18)22)21(15)25-10-4-5-11-25/h2-13H,1H3,(H,24,28)