1-[(3-chloranylphenoxy)methyl]-N-(4-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(3-chloranylphenoxy)methyl]-N-(4-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(3-chlorophenoxy)methyl]-N-(2-hydroxy-4-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(3-chlorophenoxy)methyl]-N-(2-hydroxy-4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(3-chlorophenoxy)methyl]-N-(2-hydroxy-4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(3-chlorophenoxy)methyl]-N-(2-hydroxy-4-nitro-phenyl)pyrazole-3-carboxamide Formula: C17H13ClN4O5 MolecularWeight: 388.76192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H13ClN4O5/c18-11-2-1-3-13(8-11)27-10-21-7-6-15(20-21)17(24)19-14-5-4-12(22(25)26)9-16(14)23/h1-9,23H,10H2,(H,19,24)