4-nitro-3-oxidanyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-nitro-3-oxidanyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-hydroxy-4-nitro-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-hydroxy-4-nitro-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-hydroxy-4-nitro-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-hydroxy-4-nitro-N-[2-(pyrazol-1-ylmethyl)benzyl]benzamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)CN3C=CC=N3

InChI

InChI=1S/C18H16N4O4/c23-17-10-13(6-7-16(17)22(25)26)18(24)19-11-14-4-1-2-5-15(14)12-21-9-3-8-20-21/h1-10,23H,11-12H2,(H,19,24)