3-(4-fluorophenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(2-hydroxy-5-nitro-benzyl)imidazole-4-carboxamide Formula: C17H13FN4O4 MolecularWeight: 356.307923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NC=C2C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)F

Isomeric SMILES

C1=CC(=CC=C1N2C=NC=C2C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)F

InChI

InChI=1S/C17H13FN4O4/c18-12-1-3-13(4-2-12)21-10-19-9-15(21)17(24)20-8-11-7-14(22(25)26)5-6-16(11)23/h1-7,9-10,23H,8H2,(H,20,24)