N-(5-nitro-2-oxidanyl-phenyl)hexadecanamide

Systemtic Name: N-(5-nitro-2-oxidanyl-phenyl)hexadecanamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)hexadecanamide CAS Name: N-(2-hydroxy-5-nitrophenyl)hexadecanamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)hexadecanamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)palmitamide Formula: C22H36N2O4 MolecularWeight: 392.53224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C22H36N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)23-20-18-19(24(27)28)16-17-21(20)25/h16-18,25H,2-15H2,1H3,(H,23,26)