5-(3-chlorophenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]isoxazole-3-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-(2-hydroxy-5-nitro-benzyl)isoxazole-3-carboxamide Formula: C17H12ClN3O5 MolecularWeight: 373.74728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CC(=NO2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CC(=NO2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H12ClN3O5/c18-12-3-1-2-10(6-12)16-8-14(20-26-16)17(23)19-9-11-7-13(21(24)25)4-5-15(11)22/h1-8,22H,9H2,(H,19,23)